3-methoxy-N-(2-oxoazepan-3-yl)benzamide

C14H18N2O3 — CID 15069514

IUPAC3-methoxy-N-(2-oxoazepan-3-yl)benzamide
SMILESCOc1cccc(C(=O)NC2CCCCNC2=O)c1
InChIInChI=1S/C14H18N2O3/c1-19-11-6-4-5-10(9-11)13(17)16-12-7-2-3-8-15-14(12)18/h4-6,9,12H,2-3,7-8H2,1H3,(H,15,18)(H,16,17)
InChIKeyCTXCPQBICHFWHV-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.09
Rot. Bonds3

About 3-methoxy-N-(2-oxoazepan-3-yl)benzamide

3-methoxy-N-(2-oxoazepan-3-yl)benzamide (PubChem CID 15069514) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-methoxy-N-(2-oxoazepan-3-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-N-(2-oxoazepan-3-yl)benzamide
PubChem CID15069514
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name3-methoxy-N-(2-oxoazepan-3-yl)benzamide
SMILESCOc1cccc(C(=O)NC2CCCCNC2=O)c1
InChIInChI=1S/C14H18N2O3/c1-19-11-6-4-5-10(9-11)13(17)16-12-7-2-3-8-15-14(12)18/h4-6,9,12H,2-3,7-8H2,1H3,(H,15,18)(H,16,17)
InChIKeyCTXCPQBICHFWHV-UHFFFAOYSA-N
XLogP1.09
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]-N-(2-oxoazepan-3-yl)benzamide
CID 4012629
3-(1-methylsulfonylpiperidin-4-yl)oxy-N-[(3S)-2-oxoazepan-3-yl]benzamide
CID 42287476
3-amino-5-methoxy-N-(2-oxopiperidin-3-yl)benzamide
CID 81090911
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(2-oxoazepan-3-yl)benzamide
CID 51114950
3-(3-hydroxy-3-methylbut-1-ynyl)-N-(2-oxoazepan-3-yl)benzamide
CID 50950773
N-cyclopropyl-3-methoxybenzamide
CID 900156
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(2-oxopiperidin-3-yl)benzamide
CID 47086063
7-(3-methoxyphenyl)-N-[(3S)-2-oxoazepan-3-yl]-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 93008975
6-methoxy-3-methyl-N-[(3S)-2-oxoazepan-3-yl]-1-benzofuran-2-carboxamide
CID 95122255
N-[(7S)-17-methoxy-6,13-dioxo-2-oxa-5,12-diazabicyclo[12.4.0]octadeca-1(14),15,17-trien-7-yl]-1H-pyrrole-3-carboxamide
CID 165420051
6-oxo-N-(2-oxoazepan-3-yl)-1H-pyridine-2-carboxamide
CID 107262114
3-(diethylsulfamoyl)-N-(2-oxopiperidin-3-yl)benzamide
CID 51128604

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-oxoazepan-3-yl)benzamide?
The IUPAC name of 3-methoxy-N-(2-oxoazepan-3-yl)benzamide (CID 15069514) is 3-methoxy-N-(2-oxoazepan-3-yl)benzamide.
What is the SMILES notation for 3-methoxy-N-(2-oxoazepan-3-yl)benzamide?
The canonical SMILES for 3-methoxy-N-(2-oxoazepan-3-yl)benzamide is COc1cccc(C(=O)NC2CCCCNC2=O)c1.
What is the InChIKey of 3-methoxy-N-(2-oxoazepan-3-yl)benzamide?
The InChIKey is CTXCPQBICHFWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-19-11-6-4-5-10(9-11)13(17)16-12-7-2-3-8-15-14(12)18/h4-6,9,12H,2-3,7-8H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 3-methoxy-N-(2-oxoazepan-3-yl)benzamide?
3-methoxy-N-(2-oxoazepan-3-yl)benzamide has a molecular weight of 262.31 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-oxoazepan-3-yl)benzamide is sourced from PubChem (CID 15069514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).