N-[2-(azepan-1-yl)phenyl]benzamide

C19H22N2O — CID 24652732

IUPACN-[2-(azepan-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccccc1N1CCCCCC1)c1ccccc1
InChIInChI=1S/C19H22N2O/c22-19(16-10-4-3-5-11-16)20-17-12-6-7-13-18(17)21-14-8-1-2-9-15-21/h3-7,10-13H,1-2,8-9,14-15H2,(H,20,22)
InChIKeyGWOONCHUBJUUKI-UHFFFAOYSA-N
MW294.40 g/mol
LogP4.32
Rot. Bonds3

About N-[2-(azepan-1-yl)phenyl]benzamide

N-[2-(azepan-1-yl)phenyl]benzamide (PubChem CID 24652732) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is N-[2-(azepan-1-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-(azepan-1-yl)phenyl]benzamide
PubChem CID24652732
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC NameN-[2-(azepan-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccccc1N1CCCCCC1)c1ccccc1
InChIInChI=1S/C19H22N2O/c22-19(16-10-4-3-5-11-16)20-17-12-6-7-13-18(17)21-14-8-1-2-9-15-21/h3-7,10-13H,1-2,8-9,14-15H2,(H,20,22)
InChIKeyGWOONCHUBJUUKI-UHFFFAOYSA-N
XLogP4.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(2-piperidin-1-ylphenyl)benzamide
CID 119828017
3-iodo-N-(2-piperidin-1-ylphenyl)benzamide
CID 4501683
N-[2-(azepan-1-yl)phenyl]pyridine-3-carboxamide
CID 38282179
N-[2-(azepan-1-yl)phenyl]-4-ethylbenzamide
CID 18267161
N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
CID 113092590
N-[2-(azepan-1-yl)phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 22831307
N-(2-piperidin-1-ylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 7550938
3,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 7492197
3,5-dichloro-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 16557750
5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide
CID 126661345
N-[2-(azepan-1-yl)phenyl]-4-(methylsulfamoyl)benzamide
CID 38282895
4-(2,5-dioxopyrrolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 16557741

Frequently Asked Questions

What is the IUPAC name of N-[2-(azepan-1-yl)phenyl]benzamide?
The IUPAC name of N-[2-(azepan-1-yl)phenyl]benzamide (CID 24652732) is N-[2-(azepan-1-yl)phenyl]benzamide.
What is the SMILES notation for N-[2-(azepan-1-yl)phenyl]benzamide?
The canonical SMILES for N-[2-(azepan-1-yl)phenyl]benzamide is O=C(Nc1ccccc1N1CCCCCC1)c1ccccc1.
What is the InChIKey of N-[2-(azepan-1-yl)phenyl]benzamide?
The InChIKey is GWOONCHUBJUUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c22-19(16-10-4-3-5-11-16)20-17-12-6-7-13-18(17)21-14-8-1-2-9-15-21/h3-7,10-13H,1-2,8-9,14-15H2,(H,20,22).
What are the key properties of N-[2-(azepan-1-yl)phenyl]benzamide?
N-[2-(azepan-1-yl)phenyl]benzamide has a molecular weight of 294.40 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(azepan-1-yl)phenyl]benzamide is sourced from PubChem (CID 24652732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).