N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide

C18H24F2N2O — CID 119590223

IUPACN-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide
SMILESNCC(NC(=O)C1CC1c1c(F)cccc1F)C1CCCCC1
InChIInChI=1S/C18H24F2N2O/c19-14-7-4-8-15(20)17(14)12-9-13(12)18(23)22-16(10-21)11-5-2-1-3-6-11/h4,7-8,11-13,16H,1-3,5-6,9-10,21H2,(H,22,23)
InChIKeyBDQXUVDOQNCGSD-UHFFFAOYSA-N
MW322.40 g/mol
LogP3.09
Rot. Bonds5

About N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide

N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide (PubChem CID 119590223) has the molecular formula C18H24F2N2O and a molecular weight of 322.40 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide
PubChem CID119590223
Molecular FormulaC18H24F2N2O
Molecular Weight322.40 g/mol
Exact Mass322.19
IUPAC NameN-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide
SMILESNCC(NC(=O)C1CC1c1c(F)cccc1F)C1CCCCC1
InChIInChI=1S/C18H24F2N2O/c19-14-7-4-8-15(20)17(14)12-9-13(12)18(23)22-16(10-21)11-5-2-1-3-6-11/h4,7-8,11-13,16H,1-3,5-6,9-10,21H2,(H,22,23)
InChIKeyBDQXUVDOQNCGSD-UHFFFAOYSA-N
XLogP3.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.40
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide 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

N-(1-amino-4-methylpentan-2-yl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119586711
N-[2-(cycloheptylamino)ethyl]-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide
CID 119620062
N-[2-(aminomethyl)cyclopentyl]-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide
CID 119602374
N-(2-amino-1-cyclopropylethyl)-2-(2,4-dichlorophenyl)cyclopropane-1-carboxamide
CID 119613149
N-(2-amino-1-cyclohexylethyl)-2-fluoro-6-iodobenzamide;hydrochloride
CID 119592223
N-[2-(aminomethyl)cyclopentyl]-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119602373
2-[(2-amino-1-cyclohexylethyl)amino]-6-fluorobenzamide
CID 115309592
2-[[2-(2,6-difluorophenyl)cyclopropanecarbonyl]amino]-4-methylpentanoic acid
CID 119188244
N-[3-(aminomethyl)pentan-3-yl]-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119569950
N-(2-amino-1-cyclohexylethyl)-2-bromo-4-fluorobenzamide
CID 81486052
N-(2-amino-1-cyclohexylethyl)-2,4,6-trifluorobenzamide
CID 81487271
2-(2,6-difluorophenyl)-N-[(2-hydroxycyclopentyl)methyl]cyclopropane-1-carboxamide
CID 111471310

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide (CID 119590223) is N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide is NCC(NC(=O)C1CC1c1c(F)cccc1F)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide?
The InChIKey is BDQXUVDOQNCGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24F2N2O/c19-14-7-4-8-15(20)17(14)12-9-13(12)18(23)22-16(10-21)11-5-2-1-3-6-11/h4,7-8,11-13,16H,1-3,5-6,9-10,21H2,(H,22,23).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide?
N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide has a molecular weight of 322.40 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-2-(2,6-difluorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 119590223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).