4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide

C16H22FNO — CID 112702414

IUPAC4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
SMILESCc1cc(F)ccc1C(=O)N(C)C1CCCC(C)C1
InChIInChI=1S/C16H22FNO/c1-11-5-4-6-14(9-11)18(3)16(19)15-8-7-13(17)10-12(15)2/h7-8,10-11,14H,4-6,9H2,1-3H3
InChIKeyQJDPFUSKLLUHRB-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.78
Rot. Bonds2

About 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide

4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide (PubChem CID 112702414) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
PubChem CID112702414
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC Name4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
SMILESCc1cc(F)ccc1C(=O)N(C)C1CCCC(C)C1
InChIInChI=1S/C16H22FNO/c1-11-5-4-6-14(9-11)18(3)16(19)15-8-7-13(17)10-12(15)2/h7-8,10-11,14H,4-6,9H2,1-3H3
InChIKeyQJDPFUSKLLUHRB-UHFFFAOYSA-N
XLogP3.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)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

N-cyclobutyl-4-fluoro-N,2-dimethylbenzamide
CID 115745905
N-cycloheptyl-4-fluoro-N,2-dimethylbenzamide
CID 113268593
N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
CID 115745650
4-fluoro-N,3-dimethyl-N-(3-methylcyclohexyl)benzamide
CID 63213240
N-[(3aR,6aS)-5-(dimethylamino)-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]-4-fluoro-N,2-dimethylbenzamide
CID 134704150
3-[(4-fluoro-2-methylbenzoyl)-methylamino]cyclobutane-1-carboxylic acid
CID 154763620
5-bromo-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
CID 65309384
4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
CID 102631843
4-fluoro-N-methyl-N-(3-methylcyclohexyl)-3-sulfanylbenzamide
CID 107024734
N-(2-chloroethyl)-N-cyclobutyl-4-fluoro-2-methylbenzamide
CID 102872612
N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide
CID 115745878
3-fluoro-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 115645768

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide?
The IUPAC name of 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide (CID 112702414) is 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide.
What is the SMILES notation for 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide?
The canonical SMILES for 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide is Cc1cc(F)ccc1C(=O)N(C)C1CCCC(C)C1.
What is the InChIKey of 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide?
The InChIKey is QJDPFUSKLLUHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c1-11-5-4-6-14(9-11)18(3)16(19)15-8-7-13(17)10-12(15)2/h7-8,10-11,14H,4-6,9H2,1-3H3.
What are the key properties of 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide?
4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide has a molecular weight of 263.36 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide is sourced from PubChem (CID 112702414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).