N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide

C16H23FN2O — CID 110279233

IUPACN-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide
SMILESCN(C)CC1CCCCC1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H23FN2O/c1-19(2)11-13-5-3-4-6-15(13)18-16(20)12-7-9-14(17)10-8-12/h7-10,13,15H,3-6,11H2,1-2H3,(H,18,20)
InChIKeyRDIHPDYTXZXVRW-UHFFFAOYSA-N
MW278.37 g/mol
LogP2.68
Rot. Bonds4

About N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide

N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide (PubChem CID 110279233) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide.

Molecular Properties

Compound NameN-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide
PubChem CID110279233
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC NameN-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide
SMILESCN(C)CC1CCCCC1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H23FN2O/c1-19(2)11-13-5-3-4-6-15(13)18-16(20)12-7-9-14(17)10-8-12/h7-10,13,15H,3-6,11H2,1-2H3,(H,18,20)
InChIKeyRDIHPDYTXZXVRW-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide 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-[2-[(dimethylamino)methyl]cyclohexyl]-4-methoxybenzamide
CID 110279273
N-[2-(chloromethyl)cyclohexyl]-4-fluorobenzamide
CID 114179591
4-fluoro-N-[2-[(4-fluorobenzoyl)amino]cyclohexyl]benzamide
CID 2912791
N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide
CID 110279247
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-(tetrazol-1-yl)benzamide
CID 110279154
4-fluoro-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 2098476
2-chloro-N-[2-[(dimethylamino)methyl]cyclohexyl]-6-fluorobenzamide
CID 110279243
N-[2-[(dimethylamino)methyl]cyclohexyl]-3-methoxybenzamide
CID 110279269
N-[2-(bromomethyl)cyclohexyl]-4-(dimethylamino)benzamide
CID 106367084
4-carbamothioyl-N-(2-ethylcyclohexyl)benzamide
CID 47355548
4-N-[2-(hydroxymethyl)cyclohexyl]benzene-1,4-dicarboxamide
CID 103798607
N-[2-(bromomethyl)cyclohexyl]-4-methylbenzamide
CID 114179665

Frequently Asked Questions

What is the IUPAC name of N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide?
The IUPAC name of N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide (CID 110279233) is N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide.
What is the SMILES notation for N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide?
The canonical SMILES for N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide is CN(C)CC1CCCCC1NC(=O)c1ccc(F)cc1.
What is the InChIKey of N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide?
The InChIKey is RDIHPDYTXZXVRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-19(2)11-13-5-3-4-6-15(13)18-16(20)12-7-9-14(17)10-8-12/h7-10,13,15H,3-6,11H2,1-2H3,(H,18,20).
What are the key properties of N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide?
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide has a molecular weight of 278.37 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide is sourced from PubChem (CID 110279233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).