2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide

C22H26N2O2 — CID 68907898

IUPAC2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide
SMILESNC(=O)c1ccccc1C(C(=O)NC1CCCCCC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c23-21(25)19-15-9-8-14-18(19)20(16-10-4-3-5-11-16)22(26)24-17-12-6-1-2-7-13-17/h3-5,8-11,14-15,17,20H,1-2,6-7,12-13H2,(H2,23,25)(H,24,26)
InChIKeyNEDPJDRUOSXYSU-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.76
Rot. Bonds5

About 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide

2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide (PubChem CID 68907898) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide.

Molecular Properties

Compound Name2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide
PubChem CID68907898
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide
SMILESNC(=O)c1ccccc1C(C(=O)NC1CCCCCC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c23-21(25)19-15-9-8-14-18(19)20(16-10-4-3-5-11-16)22(26)24-17-12-6-1-2-7-13-17/h3-5,8-11,14-15,17,20H,1-2,6-7,12-13H2,(H2,23,25)(H,24,26)
InChIKeyNEDPJDRUOSXYSU-UHFFFAOYSA-N
XLogP3.76
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-amino-N-cycloheptyl-2-phenylacetamide
CID 61148121
2-chloro-N-cyclohexyl-2-phenylacetamide
CID 11032339
N-[2-(cyclohexylamino)-2-oxoethyl]-2,2-diphenylacetamide
CID 1250894
(2R)-N-cyclohexyl-2-methoxy-2-phenylacetamide
CID 101462807
N-cycloheptyl-2-phenylbutanamide
CID 2890971
N-cyclohexyl-2-[(2,2-diphenylacetyl)amino]-3-phenylpropanamide
CID 3523242
1-cyclohexyl-3-[2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 15231966
1-cyclohexyl-3-[(1S,2S)-2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 70268253
(3R)-N-cyclohexyl-3-hydroxy-2,2-dimethyl-3-phenylpropanamide
CID 177440145
[1-(cyclohexylamino)-2-methylpropan-2-yl] 2,2-diphenylacetate;hydrochloride
CID 24843488
N-[6-(cyclopentylamino)pyridazin-3-yl]-2,2-diphenylacetamide
CID 113038844
N-cyclohexyl-2-(2-phenylpropylamino)propanamide
CID 115569785

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide?
The IUPAC name of 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide (CID 68907898) is 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide.
What is the SMILES notation for 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide?
The canonical SMILES for 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide is NC(=O)c1ccccc1C(C(=O)NC1CCCCCC1)c1ccccc1.
What is the InChIKey of 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide?
The InChIKey is NEDPJDRUOSXYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c23-21(25)19-15-9-8-14-18(19)20(16-10-4-3-5-11-16)22(26)24-17-12-6-1-2-7-13-17/h3-5,8-11,14-15,17,20H,1-2,6-7,12-13H2,(H2,23,25)(H,24,26).
What are the key properties of 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide?
2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide has a molecular weight of 350.46 g/mol, XLogP of 3.76, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cycloheptylamino)-2-oxo-1-phenylethyl]benzamide is sourced from PubChem (CID 68907898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).