N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide

C15H21FN2O — CID 109013439

IUPACN-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide
SMILESO=C(CCNCc1ccccc1F)NC1CCCC1
InChIInChI=1S/C15H21FN2O/c16-14-8-4-1-5-12(14)11-17-10-9-15(19)18-13-6-2-3-7-13/h1,4-5,8,13,17H,2-3,6-7,9-11H2,(H,18,19)
InChIKeyIZYIQRFJUSACCG-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.36
Rot. Bonds6

About N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide

N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide (PubChem CID 109013439) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide
PubChem CID109013439
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide
SMILESO=C(CCNCc1ccccc1F)NC1CCCC1
InChIInChI=1S/C15H21FN2O/c16-14-8-4-1-5-12(14)11-17-10-9-15(19)18-13-6-2-3-7-13/h1,4-5,8,13,17H,2-3,6-7,9-11H2,(H,18,19)
InChIKeyIZYIQRFJUSACCG-UHFFFAOYSA-N
XLogP2.36
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-cycloheptyl-3-[(2-fluorophenyl)methylamino]propanamide
CID 109020883
N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide
CID 109013440
N-cyclohexyl-3-[[N-ethyl-N'-[(2-fluorophenyl)methyl]carbamimidoyl]amino]propanamide
CID 111267039
2-[[[3-(cyclopropylamino)-3-oxopropyl]amino]methyl]benzamide
CID 79395029
3-[(2-fluorophenyl)methylamino]-N-phenylpropanamide
CID 109020896
N-cyclopropyl-3-[[2-(difluoromethoxy)phenyl]methylamino]propanamide
CID 78977855
3-(cyclohexylcarbamoylamino)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 18152351
3-[(2-fluorophenyl)methylamino]propanamide
CID 43090001
3-N-cyclopentyl-1-N-[(2-fluorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109051825
N-(4-aminocyclohexyl)-2-(2-fluorophenyl)acetamide
CID 43653105
4-(cyclohexylcarbamoylamino)-N-[2-(2-fluorophenyl)ethyl]butanamide
CID 18152352
2-(2-fluorophenyl)-N-[4-(hydroxymethyl)cyclohexyl]acetamide
CID 115270081

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide?
The IUPAC name of N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide (CID 109013439) is N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide?
The canonical SMILES for N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide is O=C(CCNCc1ccccc1F)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide?
The InChIKey is IZYIQRFJUSACCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c16-14-8-4-1-5-12(14)11-17-10-9-15(19)18-13-6-2-3-7-13/h1,4-5,8,13,17H,2-3,6-7,9-11H2,(H,18,19).
What are the key properties of N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide?
N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide has a molecular weight of 264.34 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide is sourced from PubChem (CID 109013439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).