N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine

C15H22FN — CID 62528134

IUPACN-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)Cc1cccc(F)c1
InChIInChI=1S/C15H22FN/c1-2-4-13(11-17-15-7-8-15)9-12-5-3-6-14(16)10-12/h3,5-6,10,13,15,17H,2,4,7-9,11H2,1H3
InChIKeyZZDQOWWSEQSTGS-UHFFFAOYSA-N
MW235.35 g/mol
LogP3.54
Rot. Bonds7

About N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine

N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine (PubChem CID 62528134) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine
PubChem CID62528134
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC NameN-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)Cc1cccc(F)c1
InChIInChI=1S/C15H22FN/c1-2-4-13(11-17-15-7-8-15)9-12-5-3-6-14(16)10-12/h3,5-6,10,13,15,17H,2,4,7-9,11H2,1H3
InChIKeyZZDQOWWSEQSTGS-UHFFFAOYSA-N
XLogP3.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-[[3-(trifluoromethyl)phenyl]methyl]pentyl]cyclopropanamine
CID 62528327
N-[4-(3-fluorophenyl)-2,3-dimethylbutyl]cyclopropanamine
CID 81016597
N-[2-[(3,4-dimethylphenyl)methyl]pentyl]cyclopropanamine
CID 62528938
N-[2-[(3-fluorophenyl)methyl]-3-(furan-2-yl)propyl]cyclopropanamine
CID 62998866
1-[2-(chloromethyl)pentyl]-3-fluorobenzene
CID 66034090
N-[2-[(3-chlorophenyl)methyl]octyl]cyclopropanamine
CID 63521924
2-[(3-fluorophenyl)methyl]-N-(2-methoxyethyl)pentan-1-amine
CID 55134646
N-[2-[(2-chloro-6-fluorophenyl)methyl]pentyl]cyclopropanamine
CID 62528339
N-[2-[(2-chloro-3-fluorophenyl)methyl]pentyl]cyclopropanamine
CID 112654147
N-[2-(3-fluorophenoxy)pentyl]cyclopropanamine
CID 83043805
N-(2-benzyl-4-methylheptyl)cyclopropanamine
CID 55196781
N-[2-(4-bromophenyl)-3-(3-fluorophenyl)propyl]cyclopropanamine
CID 79430769

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine?
The IUPAC name of N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine (CID 62528134) is N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine.
What is the SMILES notation for N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine?
The canonical SMILES for N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine is CCCC(CNC1CC1)Cc1cccc(F)c1.
What is the InChIKey of N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine?
The InChIKey is ZZDQOWWSEQSTGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-2-4-13(11-17-15-7-8-15)9-12-5-3-6-14(16)10-12/h3,5-6,10,13,15,17H,2,4,7-9,11H2,1H3.
What are the key properties of N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine?
N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine has a molecular weight of 235.35 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine is sourced from PubChem (CID 62528134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).