3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide

C22H22N2O3 — CID 87018968

IUPAC3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide
SMILESO=C(CCn1ccccc1=O)NCc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C22H22N2O3/c25-21(12-14-24-13-5-4-11-22(24)26)23-16-19-9-6-10-20(15-19)27-17-18-7-2-1-3-8-18/h1-11,13,15H,12,14,16-17H2,(H,23,25)
InChIKeyIVBCDRFXZYEIMN-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.13
Rot. Bonds8

About 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide

3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide (PubChem CID 87018968) has the molecular formula C22H22N2O3 and a molecular weight of 362.43 g/mol. Its IUPAC name is 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide
PubChem CID87018968
Molecular FormulaC22H22N2O3
Molecular Weight362.43 g/mol
Exact Mass362.16
IUPAC Name3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide
SMILESO=C(CCn1ccccc1=O)NCc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C22H22N2O3/c25-21(12-14-24-13-5-4-11-22(24)26)23-16-19-9-6-10-20(15-19)27-17-18-7-2-1-3-8-18/h1-11,13,15H,12,14,16-17H2,(H,23,25)
InChIKeyIVBCDRFXZYEIMN-UHFFFAOYSA-N
XLogP3.13
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-methoxyphenyl)ethyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 78879278
N-[(4-fluorophenyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86979441
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 110908908
tert-butyl N-[3-oxo-3-[(3-phenylmethoxyphenyl)methylamino]propyl]carbamate
CID 55846532
N-[(3-phenylmethoxyphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)propanamide
CID 55843576
N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86979608
2-(2-oxopyrrolidin-1-yl)-N-[(3-phenylmethoxyphenyl)methyl]acetamide
CID 129367971
N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide
CID 82898701
N-[4-oxo-4-[(3-phenylmethoxyphenyl)methylamino]butyl]furan-2-carboxamide
CID 55845508
N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide
CID 69313120
3-(4-oxoquinazolin-3-yl)-N-[(3-pyridin-2-yloxyphenyl)methyl]propanamide
CID 72719244
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide
CID 55846406

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide?
The IUPAC name of 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide (CID 87018968) is 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide.
What is the SMILES notation for 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide?
The canonical SMILES for 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide is O=C(CCn1ccccc1=O)NCc1cccc(OCc2ccccc2)c1.
What is the InChIKey of 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide?
The InChIKey is IVBCDRFXZYEIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3/c25-21(12-14-24-13-5-4-11-22(24)26)23-16-19-9-6-10-20(15-19)27-17-18-7-2-1-3-8-18/h1-11,13,15H,12,14,16-17H2,(H,23,25).
What are the key properties of 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide?
3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide has a molecular weight of 362.43 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide is sourced from PubChem (CID 87018968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).