N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide

C15H21FN2O — CID 109013440

IUPACN-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide
SMILESO=C(CCNCc1ccc(F)cc1)NC1CCCC1
InChIInChI=1S/C15H21FN2O/c16-13-7-5-12(6-8-13)11-17-10-9-15(19)18-14-3-1-2-4-14/h5-8,14,17H,1-4,9-11H2,(H,18,19)
InChIKeyNHXYUVIZGZQBDF-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.36
Rot. Bonds6

About N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide

N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide (PubChem CID 109013440) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide
PubChem CID109013440
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide
SMILESO=C(CCNCc1ccc(F)cc1)NC1CCCC1
InChIInChI=1S/C15H21FN2O/c16-13-7-5-12(6-8-13)11-17-10-9-15(19)18-14-3-1-2-4-14/h5-8,14,17H,1-4,9-11H2,(H,18,19)
InChIKeyNHXYUVIZGZQBDF-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-cyclopropyl-3-[(4-methylphenyl)methylamino]propanamide
CID 55090993
N-cyclopentyl-3-[(2-fluorophenyl)methylamino]propanamide
CID 109013439
N-cycloheptyl-3-[(2-fluorophenyl)methylamino]propanamide
CID 109020883
N-cyclopentyl-3-[(3-methylphenyl)methylamino]propanamide
CID 109013435
N-cyclopropyl-3-[(4-nitrophenyl)methylamino]propanamide
CID 62316575
N-cyclopropyl-3-(2,3-dihydro-1H-inden-5-ylmethylamino)propanamide
CID 79036237
N-cyclohexyl-3-[(3-methylphenyl)methylamino]propanamide
CID 109013960
N-cyclopropyl-3-[(4-pyrazol-1-ylphenyl)methylamino]propanamide
CID 78978276
N-cyclohexyl-3-[[N-ethyl-N'-[(4-fluorophenyl)methyl]carbamimidoyl]amino]propanamide;hydroiodide
CID 111233542
N-cyclopentyl-3-[[N-[2-(4-fluorophenyl)ethyl]-N'-methylcarbamimidoyl]amino]propanamide;hydroiodide
CID 111229934
3-[2-(4-chlorophenyl)ethylamino]-N-cyclopentylpropanamide
CID 109013461
N-cyclopropyl-3-[[4-(N'-hydroxycarbamimidoyl)phenyl]methylamino]propanamide
CID 79401252

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide?
The IUPAC name of N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide (CID 109013440) is N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide?
The canonical SMILES for N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide is O=C(CCNCc1ccc(F)cc1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide?
The InChIKey is NHXYUVIZGZQBDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c16-13-7-5-12(6-8-13)11-17-10-9-15(19)18-14-3-1-2-4-14/h5-8,14,17H,1-4,9-11H2,(H,18,19).
What are the key properties of N-cyclopentyl-3-[(4-fluorophenyl)methylamino]propanamide?
N-cyclopentyl-3-[(4-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-[(4-fluorophenyl)methylamino]propanamide is sourced from PubChem (CID 109013440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).