N-[2-(2-hydroxyethyl)-3-methoxyphenyl]-2,2-dimethylpropanamide

N-[2-(2-hydroxyethyl)-3-methoxyphenyl]-2,2-dimethylpropanamide

CAS: 76093-72-6

Formula: C14H21NO3

SMILES: COC1=CC=CC(NC(=O)C(C)(C)C)=C1CCO

IUPAC: N-[2-(2-hydroxyethyl)-3-methoxyphenyl]-2,2-dimethylpropanamide

InChI: InChI=1S/C14H21NO3/c1-14(2,3)13(17)15-11-6-5-7-12(18-4)10(11)8-9-16/h5-7,16H,8-9H2,1-4H3,(H,15,17)

Composition: C (66.91%), H (8.42%), N (5.57%), O (19.10%)

Molar Mass: 251.326

Atom Count: 39

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	251.15214354
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	VLQCFCOZILVCKP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.66
Topological Polar Surface Area	58.56
Polarizability	27.48
Ring Count	1
Rotatable Bond Count	5

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