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2-{[(1S)-1-phenylethyl]amino}cyclopentan-1-ol

2-{[(1S)-1-phenylethyl]amino}cyclopentan-1-ol

CAS: 537688-49-6

Formula: C13H19NO

SMILES: C[C@H](NC1CCCC1O)C1=CC=CC=C1

IUPAC: 2-{[(1S)-1-phenylethyl]amino}cyclopentan-1-ol

InChI: InChI=1S/C13H19NO/c1-10(11-6-3-2-4-7-11)14-12-8-5-9-13(12)15/h2-4,6-7,10,12-15H,5,8-9H2,1H3/t10-,12?,13?/m0/s1

Composition: C (76.06%), H (9.33%), N (6.82%), O (7.79%)

Molar Mass: 205.301

Atom Count: 34

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 3
Exact Mass 205.146664236
Formal Charge 0
FSP3 0.54
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey XRTOQDRFDAUSLY-PKSQDBQZSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.5
Topological Polar Surface Area 32.26
Polarizability 24.65
Ring Count 2
Rotatable Bond Count 3

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