N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine

C13H18FN — CID 62397881

IUPACN-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine
SMILESCCC(NC1CC1C)c1ccc(F)cc1
InChIInChI=1S/C13H18FN/c1-3-12(15-13-8-9(13)2)10-4-6-11(14)7-5-10/h4-7,9,12-13,15H,3,8H2,1-2H3
InChIKeyXTFXXYCYMRVINP-UHFFFAOYSA-N
MW207.29 g/mol
LogP3.27
Rot. Bonds4

About N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine

N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine (PubChem CID 62397881) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine
PubChem CID62397881
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC NameN-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine
SMILESCCC(NC1CC1C)c1ccc(F)cc1
InChIInChI=1S/C13H18FN/c1-3-12(15-13-8-9(13)2)10-4-6-11(14)7-5-10/h4-7,9,12-13,15H,3,8H2,1-2H3
InChIKeyXTFXXYCYMRVINP-UHFFFAOYSA-N
XLogP3.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine 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-methyl-N-[1-(4-methylphenyl)propyl]cyclopropan-1-amine
CID 62397495
4-[1-[(2-methylcyclopropyl)amino]propyl]phenol
CID 62398897
2,4-dimethyl-N-[1-(4-methylphenyl)propyl]cyclohexan-1-amine
CID 63994661
1-ethyl-N-[1-(4-fluorophenyl)propyl]piperidin-4-amine
CID 54917034
N-(cyclopropylmethyl)-1-(4-fluorophenyl)propan-1-amine
CID 43190691
N-[1-(4-chlorophenyl)propyl]-2,4-dimethylcyclohexan-1-amine
CID 63994473
2-methyl-N-[1-(4-methylphenyl)propyl]cyclohexan-1-amine
CID 43079704
1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine
CID 43096584
N-[1-(4-fluorophenyl)propyl]oxan-3-amine
CID 63360091
1,2,5-trimethyl-N-(1-phenylpropyl)piperidin-4-amine
CID 62305036
2,4-dimethyl-N-(1-phenylpropyl)cyclohexan-1-amine
CID 63994859
1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol
CID 62397151

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine?
The IUPAC name of N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine (CID 62397881) is N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine.
What is the SMILES notation for N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine?
The canonical SMILES for N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine is CCC(NC1CC1C)c1ccc(F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine?
The InChIKey is XTFXXYCYMRVINP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-3-12(15-13-8-9(13)2)10-4-6-11(14)7-5-10/h4-7,9,12-13,15H,3,8H2,1-2H3.
What are the key properties of N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine?
N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine has a molecular weight of 207.29 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine is sourced from PubChem (CID 62397881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).