2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide

C15H21FN2O — CID 64683966

IUPAC2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide
SMILESNC1(CC(=O)NCc2cccc(F)c2)CCCCC1
InChIInChI=1S/C15H21FN2O/c16-13-6-4-5-12(9-13)11-18-14(19)10-15(17)7-2-1-3-8-15/h4-6,9H,1-3,7-8,10-11,17H2,(H,18,19)
InChIKeyRDZCCXLSCUGSOC-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.49
Rot. Bonds4

About 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide

2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide (PubChem CID 64683966) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide
PubChem CID64683966
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide
SMILESNC1(CC(=O)NCc2cccc(F)c2)CCCCC1
InChIInChI=1S/C15H21FN2O/c16-13-6-4-5-12(9-13)11-18-14(19)10-15(17)7-2-1-3-8-15/h4-6,9H,1-3,7-8,10-11,17H2,(H,18,19)
InChIKeyRDZCCXLSCUGSOC-UHFFFAOYSA-N
XLogP2.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide 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-(1-aminocyclopentyl)-N-[(3-chlorophenyl)methyl]acetamide
CID 64684380
3-[[[2-(1-aminocyclopentyl)acetyl]amino]methyl]benzoic acid
CID 64678387
N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide
CID 110907192
2-(1-aminocyclobutyl)-N-[2-(benzylamino)-2-oxoethyl]acetamide
CID 79854273
2-[1-[(3-fluorophenyl)methylcarbamoylamino]cyclopentyl]acetic acid
CID 64701035
N-[(3-fluorophenyl)methyl]-1-(N'-hydroxycarbamimidoyl)cyclohexane-1-carboxamide
CID 76919450
2-(1-aminocyclohexyl)-N-[(4-cyanophenyl)methyl]acetamide
CID 64684065
2-(1-aminocyclohexyl)-N-[2-(3-methylphenyl)ethyl]acetamide
CID 64679676
2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 64677041
4-[(3-fluorophenyl)methylamino]-4-oxobutanoic acid
CID 43529773
4-amino-N-[(3-fluorophenyl)methyl]butanamide;hydrochloride
CID 119279529
1-[(3-fluorophenyl)methyl]-3-sulfanylurea
CID 141033956

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide (CID 64683966) is 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide is NC1(CC(=O)NCc2cccc(F)c2)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide?
The InChIKey is RDZCCXLSCUGSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c16-13-6-4-5-12(9-13)11-18-14(19)10-15(17)7-2-1-3-8-15/h4-6,9H,1-3,7-8,10-11,17H2,(H,18,19).
What are the key properties of 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide?
2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide has a molecular weight of 264.34 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-[(3-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 64683966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).