2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine

C15H18FN — CID 167278339

IUPAC2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine
SMILESC=C=C1CCCCC1(NC)c1ccc(F)cc1
InChIInChI=1S/C15H18FN/c1-3-12-6-4-5-11-15(12,17-2)13-7-9-14(16)10-8-13/h7-10,17H,1,4-6,11H2,2H3
InChIKeyCCHKDVIJEWWXOW-UHFFFAOYSA-N
MW231.31 g/mol
LogP3.53
Rot. Bonds2

About 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine

2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine (PubChem CID 167278339) has the molecular formula C15H18FN and a molecular weight of 231.31 g/mol. Its IUPAC name is 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine
PubChem CID167278339
Molecular FormulaC15H18FN
Molecular Weight231.31 g/mol
Exact Mass231.14
IUPAC Name2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine
SMILESC=C=C1CCCCC1(NC)c1ccc(F)cc1
InChIInChI=1S/C15H18FN/c1-3-12-6-4-5-11-15(12,17-2)13-7-9-14(16)10-8-13/h7-10,17H,1,4-6,11H2,2H3
InChIKeyCCHKDVIJEWWXOW-UHFFFAOYSA-N
XLogP3.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.31
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine 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-(4-fluorophenyl)-2-(methylamino)cyclohexan-1-one;hydrochloride
CID 172627580
1-(4-fluorophenyl)-N-methylcyclopropan-1-amine;hydrochloride
CID 175205869
(2S)-2-(methylamino)-2-[4-(trifluoromethyl)phenyl]cyclohexan-1-one
CID 156803398
azane;1-fluoro-4-(1-methylcyclopentyl)benzene
CID 174449315
(2R)-2-(methylamino)-2-phenylcyclohexan-1-one
CID 94478337
1-[1-(4-fluorophenyl)cyclohexyl]-N-methylmethanamine
CID 58954797
(NE)-N-[2-(methylamino)-2-phenylcyclohexylidene]hydroxylamine
CID 138976612
1-(1-ethenylcyclohexyl)-4-fluorobenzene
CID 141324071
1-[1-(difluoromethyl)cyclopentyl]-4-fluorobenzene
CID 84723635
N-[1-(4-fluorophenyl)cyclopentyl]acetamide
CID 71936960
(2R)-2-(2-fluorophenyl)-2-(methylamino)cyclohexan-1-one;hydrochloride
CID 171381722
4,4-bis(4-fluorophenyl)cyclohexan-1-one
CID 21295671

Frequently Asked Questions

What is the IUPAC name of 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine?
The IUPAC name of 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine (CID 167278339) is 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine is C=C=C1CCCCC1(NC)c1ccc(F)cc1.
What is the InChIKey of 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine?
The InChIKey is CCHKDVIJEWWXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN/c1-3-12-6-4-5-11-15(12,17-2)13-7-9-14(16)10-8-13/h7-10,17H,1,4-6,11H2,2H3.
What are the key properties of 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine?
2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine has a molecular weight of 231.31 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylidene-1-(4-fluorophenyl)-N-methylcyclohexan-1-amine is sourced from PubChem (CID 167278339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).