N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide

C17H19NO2 — CID 93032888

IUPACN-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC[C@@H](O)c1ccccc1
InChIInChI=1S/C17H19NO2/c19-16(15-9-5-2-6-10-15)13-18-17(20)12-11-14-7-3-1-4-8-14/h1-10,16,19H,11-13H2,(H,18,20)/t16-/m1/s1
InChIKeyNVSJJVCYWZAJKC-MRXNPFEDSA-N
MW269.34 g/mol
LogP2.47
Rot. Bonds6

About N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide

N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide (PubChem CID 93032888) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
PubChem CID93032888
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC[C@@H](O)c1ccccc1
InChIInChI=1S/C17H19NO2/c19-16(15-9-5-2-6-10-15)13-18-17(20)12-11-14-7-3-1-4-8-14/h1-10,16,19H,11-13H2,(H,18,20)/t16-/m1/s1
InChIKeyNVSJJVCYWZAJKC-MRXNPFEDSA-N
XLogP2.47
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-aminophenyl)-N-(2-hydroxy-2-phenylethyl)propanamide
CID 61036910
3-amino-N-(2-hydroxy-2-phenylethyl)propanamide
CID 43500072
N-[2-[4-(difluoromethoxy)phenyl]-2-hydroxyethyl]-3-phenylpropanamide
CID 111424772
3-(2-chlorophenyl)-N-(2-hydroxy-2-phenylethyl)propanamide
CID 43391345
N-(2-hydroxy-2-phenylethyl)-2-methoxyacetamide
CID 60654245
N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide
CID 9184966
3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide
CID 71911698
3-(4-ethylphenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]propanamide
CID 110888819
3-(4-methylphenyl)-N-(2-phenylpropyl)propanamide
CID 133229339
3-[2-[(2-hydroxy-2-phenylethyl)amino]-2-oxoethyl]pentanedioic acid
CID 174644675
N-[2-hydroxy-2-(1-methyl-2,3-dihydroindol-5-yl)ethyl]-3-phenylpropanamide
CID 90582153
N-(2-bromo-2-cyclopropylethyl)-3-phenylpropanamide
CID 114315834

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide?
The IUPAC name of N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide (CID 93032888) is N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide?
The canonical SMILES for N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide is O=C(CCc1ccccc1)NC[C@@H](O)c1ccccc1.
What is the InChIKey of N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide?
The InChIKey is NVSJJVCYWZAJKC-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H19NO2/c19-16(15-9-5-2-6-10-15)13-18-17(20)12-11-14-7-3-1-4-8-14/h1-10,16,19H,11-13H2,(H,18,20)/t16-/m1/s1.
What are the key properties of N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide?
N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide has a molecular weight of 269.34 g/mol, XLogP of 2.47, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide is sourced from PubChem (CID 93032888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).