2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide

C25H29FN2O3 — CID 39430130

IUPAC2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
SMILESO=C(NCC1(N2CCOCC2)CCCCC1)c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C25H29FN2O3/c26-20-10-8-19(9-11-20)23(29)21-6-2-3-7-22(21)24(30)27-18-25(12-4-1-5-13-25)28-14-16-31-17-15-28/h2-3,6-11H,1,4-5,12-18H2,(H,27,30)
InChIKeyQNGVFHIGIFTHTF-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.82
Rot. Bonds6

About 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide

2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide (PubChem CID 39430130) has the molecular formula C25H29FN2O3 and a molecular weight of 424.52 g/mol. Its IUPAC name is 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
PubChem CID39430130
Molecular FormulaC25H29FN2O3
Molecular Weight424.52 g/mol
Exact Mass424.22
IUPAC Name2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
SMILESO=C(NCC1(N2CCOCC2)CCCCC1)c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C25H29FN2O3/c26-20-10-8-19(9-11-20)23(29)21-6-2-3-7-22(21)24(30)27-18-25(12-4-1-5-13-25)28-14-16-31-17-15-28/h2-3,6-11H,1,4-5,12-18H2,(H,27,30)
InChIKeyQNGVFHIGIFTHTF-UHFFFAOYSA-N
XLogP3.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)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

2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide;hydrochloride
CID 20995028
3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139028737
5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 18150722
N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-propoxybenzamide;hydrochloride
CID 20994940
4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 2559826
3-fluoro-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 78784195
2-fluoro-N-[(4-morpholin-4-ylthian-4-yl)methyl]benzamide
CID 139028683
4-(difluoromethylsulfanyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 18148355
4-morpholin-4-yl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]benzamide
CID 91792119
4-(difluoromethylsulfonyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 8502045
2-(4-fluorophenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]cyclopropane-1-carboxamide
CID 51330819
2-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-nitrobenzamide
CID 43005191

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The IUPAC name of 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide (CID 39430130) is 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide.
What is the SMILES notation for 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The canonical SMILES for 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide is O=C(NCC1(N2CCOCC2)CCCCC1)c1ccccc1C(=O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The InChIKey is QNGVFHIGIFTHTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29FN2O3/c26-20-10-8-19(9-11-20)23(29)21-6-2-3-7-22(21)24(30)27-18-25(12-4-1-5-13-25)28-14-16-31-17-15-28/h2-3,6-11H,1,4-5,12-18H2,(H,27,30).
What are the key properties of 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide has a molecular weight of 424.52 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide is sourced from PubChem (CID 39430130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).