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(2S,3S)-2-amino-3-methyl-N-[2-(morpholin-4-yl)ethyl]pentanamide

(2S,3S)-2-amino-3-methyl-N-[2-(morpholin-4-yl)ethyl]pentanamide

CAS: 102562-74-3

Formula: C12H25N3O2

SMILES: CC[C@H](C)[C@H](N)C(=O)NCCN1CCOCC1

IUPAC: (2S,3S)-2-amino-3-methyl-N-[2-(morpholin-4-yl)ethyl]pentanamide

InChI: InChI=1S/C12H25N3O2/c1-3-10(2)11(13)12(16)14-4-5-15-6-8-17-9-7-15/h10-11H,3-9,13H2,1-2H3,(H,14,16)/t10-,11-/m0/s1

Composition: C (59.23%), H (10.36%), N (17.27%), O (13.15%)

Molar Mass: 243.351

Atom Count: 42

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 243.194677057
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey YNMUTYLWSRFTPX-QWRGUYRKSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.91
Topological Polar Surface Area 67.59
Polarizability 27.06
Ring Count 1
Rotatable Bond Count 6

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