N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide

C16H18N2O3 — CID 103945268

IUPACN-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide
SMILESO=C(CCn1ccccc1=O)N[C@H](CO)c1ccccc1
InChIInChI=1S/C16H18N2O3/c19-12-14(13-6-2-1-3-7-13)17-15(20)9-11-18-10-5-4-8-16(18)21/h1-8,10,14,19H,9,11-12H2,(H,17,20)/t14-/m1/s1
InChIKeyKYZHYRZETGBOEC-CQSZACIVSA-N
MW286.33 g/mol
LogP1.09
Rot. Bonds6

About N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide

N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 103945268) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID103945268
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide
SMILESO=C(CCn1ccccc1=O)N[C@H](CO)c1ccccc1
InChIInChI=1S/C16H18N2O3/c19-12-14(13-6-2-1-3-7-13)17-15(20)9-11-18-10-5-4-8-16(18)21/h1-8,10,14,19H,9,11-12H2,(H,17,20)/t14-/m1/s1
InChIKeyKYZHYRZETGBOEC-CQSZACIVSA-N
XLogP1.09
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R)-2-hydroxy-1-phenylethyl]-3-pyrrolidin-1-ylpropanamide
CID 103944653
N-[1-(3-chlorophenyl)propyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86979645
N-(2-hydroxy-1-phenylethyl)-4-pyrazol-1-ylbutanamide
CID 91638874
N-(2-hydroxy-1-phenylethyl)butanamide
CID 63184192
4-hydroxy-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
CID 107863809
3-(2-oxo-1-pyridinyl)propanehydrazide
CID 43346089
2-methyl-4-[3-(2-oxo-1-pyridinyl)propanoylamino]butanoic acid
CID 80539147
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide
CID 103941143
4-hydroxy-N-(2-hydroxy-1-phenylethyl)pentanamide
CID 79203204
N-[(1S)-2-hydroxy-1-phenylethyl]-3-phenylsulfanylpropanamide
CID 103944973
5-chloro-N-[(1R)-2-hydroxy-1-phenylethyl]pentanamide
CID 107862734
N-[(1R)-2-hydroxy-1-phenylethyl]pent-4-enamide
CID 67310926

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide (CID 103945268) is N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide is O=C(CCn1ccccc1=O)N[C@H](CO)c1ccccc1.
What is the InChIKey of N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is KYZHYRZETGBOEC-CQSZACIVSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-12-14(13-6-2-1-3-7-13)17-15(20)9-11-18-10-5-4-8-16(18)21/h1-8,10,14,19H,9,11-12H2,(H,17,20)/t14-/m1/s1.
What are the key properties of N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide?
N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 286.33 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-hydroxy-1-phenylethyl]-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 103945268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).