4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide

C17H20N2O2 — CID 20820039

IUPAC4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(Cn2cc(C)ccc2=O)cc1
InChIInChI=1S/C17H20N2O2/c1-3-10-18-17(21)15-7-5-14(6-8-15)12-19-11-13(2)4-9-16(19)20/h4-9,11H,3,10,12H2,1-2H3,(H,18,21)
InChIKeyWUONHHMALXLSOW-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.34
Rot. Bonds5

About 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide

4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide (PubChem CID 20820039) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide.

Molecular Properties

Compound Name4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide
PubChem CID20820039
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(Cn2cc(C)ccc2=O)cc1
InChIInChI=1S/C17H20N2O2/c1-3-10-18-17(21)15-7-5-14(6-8-15)12-19-11-13(2)4-9-16(19)20/h4-9,11H,3,10,12H2,1-2H3,(H,18,21)
InChIKeyWUONHHMALXLSOW-UHFFFAOYSA-N
XLogP2.34
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(azepan-1-ylmethyl)-N-propylbenzamide
CID 43924202
ethane;4-ethyl-N-propylbenzamide
CID 142831348
1-tert-butyl-4-methylbenzene;bis(4-tert-butyl-N-propylbenzamide)
CID 159281863
4-[(2-oxopyrrolidin-1-yl)methyl]-N-propylbenzamide
CID 32745199
4-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-propylbenzamide
CID 4256627
4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-propylbenzamide
CID 43924194
1-[[1-[(4-methylphenyl)methyl]-6-oxopyridine-3-carbonyl]amino]-3-phenylurea
CID 30859594
1-[(4-methylphenyl)methyl]-6-oxo-N-(2,3,4-trifluorophenyl)pyridine-3-carboxamide
CID 8697162
4-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]-N-propylbenzamide
CID 46324669
N-(2,5-dimethylphenyl)-1-[(4-nitrophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8697984
2-[(4-ethylbenzoyl)amino]-6-methyl-N-propylimidazo[1,2-a]pyridine-3-carboxamide
CID 155544729
4-[[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]methyl]-N-butylbenzamide
CID 78872433

Frequently Asked Questions

What is the IUPAC name of 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide?
The IUPAC name of 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide (CID 20820039) is 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide.
What is the SMILES notation for 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide?
The canonical SMILES for 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide is CCCNC(=O)c1ccc(Cn2cc(C)ccc2=O)cc1.
What is the InChIKey of 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide?
The InChIKey is WUONHHMALXLSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-10-18-17(21)15-7-5-14(6-8-15)12-19-11-13(2)4-9-16(19)20/h4-9,11H,3,10,12H2,1-2H3,(H,18,21).
What are the key properties of 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide?
4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-methyl-2-oxo-1-pyridinyl)methyl]-N-propylbenzamide is sourced from PubChem (CID 20820039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).