3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide

C21H21FN2O2 — CID 34577765

IUPAC3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide
SMILESO=C(Nc1cccc(C(=O)N(Cc2ccccc2F)C2CC2)c1)C1CC1
InChIInChI=1S/C21H21FN2O2/c22-19-7-2-1-4-16(19)13-24(18-10-11-18)21(26)15-5-3-6-17(12-15)23-20(25)14-8-9-14/h1-7,12,14,18H,8-11,13H2,(H,23,25)
InChIKeyYZOBJBQOTZDQBQ-UHFFFAOYSA-N
MW352.41 g/mol
LogP3.98
Rot. Bonds6

About 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide

3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide (PubChem CID 34577765) has the molecular formula C21H21FN2O2 and a molecular weight of 352.41 g/mol. Its IUPAC name is 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide.

Molecular Properties

Compound Name3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide
PubChem CID34577765
Molecular FormulaC21H21FN2O2
Molecular Weight352.41 g/mol
Exact Mass352.16
IUPAC Name3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide
SMILESO=C(Nc1cccc(C(=O)N(Cc2ccccc2F)C2CC2)c1)C1CC1
InChIInChI=1S/C21H21FN2O2/c22-19-7-2-1-4-16(19)13-24(18-10-11-18)21(26)15-5-3-6-17(12-15)23-20(25)14-8-9-14/h1-7,12,14,18H,8-11,13H2,(H,23,25)
InChIKeyYZOBJBQOTZDQBQ-UHFFFAOYSA-N
XLogP3.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.41
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]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

4-N-(3-fluorophenyl)-1-N-[(2-fluorophenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 109148399
N-cyclopropyl-N-[(2-fluorophenyl)methyl]-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 34576472
N-cyclopropyl-N-[(2-fluorophenyl)methyl]-3-propoxybenzamide
CID 55772522
1-N,4-N-dicyclopropyl-1-N,4-N-bis[(2-fluorophenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 134013706
N-(4-aminocyclohexyl)-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-3,5-difluorobenzamide
CID 23762833
N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclopentanecarbonylamino)phenyl]methyl]-3-fluorobenzamide
CID 23935406
1-N,4-N-bis[3-(diethylcarbamoyl)phenyl]cyclohexane-1,4-dicarboxamide
CID 17195088
3-(cyclopropanecarbonylamino)-N-piperidin-4-yl-N-propylbenzamide
CID 119824906
3-(cyclopropanecarbonylamino)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylbenzamide
CID 51146977
N-(2-aminoethyl)-3-(cyclopropanecarbonylamino)benzamide;hydrochloride
CID 119384006
6-bromo-N-cyclopropyl-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 103874178
4-[4-[cyclopropyl-[(2-fluorophenyl)methyl]carbamoyl]phenoxy]benzamide
CID 56545378

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide?
The IUPAC name of 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide (CID 34577765) is 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide.
What is the SMILES notation for 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide?
The canonical SMILES for 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide is O=C(Nc1cccc(C(=O)N(Cc2ccccc2F)C2CC2)c1)C1CC1.
What is the InChIKey of 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide?
The InChIKey is YZOBJBQOTZDQBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21FN2O2/c22-19-7-2-1-4-16(19)13-24(18-10-11-18)21(26)15-5-3-6-17(12-15)23-20(25)14-8-9-14/h1-7,12,14,18H,8-11,13H2,(H,23,25).
What are the key properties of 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide?
3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide has a molecular weight of 352.41 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropanecarbonylamino)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]benzamide is sourced from PubChem (CID 34577765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).