N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine

C17H26FN — CID 79440904

IUPACN-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine
SMILESCCCC(C)CC(CNC1CC1)c1cccc(F)c1
InChIInChI=1S/C17H26FN/c1-3-5-13(2)10-15(12-19-17-8-9-17)14-6-4-7-16(18)11-14/h4,6-7,11,13,15,17,19H,3,5,8-10,12H2,1-2H3
InChIKeyOFANWQOHKBLERY-UHFFFAOYSA-N
MW263.40 g/mol
LogP4.49
Rot. Bonds8

About N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine

N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine (PubChem CID 79440904) has the molecular formula C17H26FN and a molecular weight of 263.40 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine
PubChem CID79440904
Molecular FormulaC17H26FN
Molecular Weight263.40 g/mol
Exact Mass263.20
IUPAC NameN-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine
SMILESCCCC(C)CC(CNC1CC1)c1cccc(F)c1
InChIInChI=1S/C17H26FN/c1-3-5-13(2)10-15(12-19-17-8-9-17)14-6-4-7-16(18)11-14/h4,6-7,11,13,15,17,19H,3,5,8-10,12H2,1-2H3
InChIKeyOFANWQOHKBLERY-UHFFFAOYSA-N
XLogP4.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.40
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(3-fluorophenyl)nonyl]cyclopropanamine
CID 79440903
N-[2-(3-fluorophenyl)-2-pentan-2-yloxyethyl]cyclopropanamine
CID 102984848
2-(3-fluorophenyl)-N-(2-methoxyethyl)-4-methylheptan-1-amine
CID 79442641
N'-cyclopropyl-1-(3-fluorophenyl)ethane-1,2-diamine
CID 117242573
N-[3-(5-bromothiophen-2-yl)-2-(3-fluorophenyl)propyl]cyclopropanamine
CID 79440980
N-[4-ethyl-2-(3-methylphenyl)octyl]cyclopropanamine
CID 79422736
N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine
CID 62528134
N-[3-(2-bromophenyl)-2-(3-fluorophenyl)propyl]cyclopropanamine
CID 79432897
N-[2-(3-fluorophenyl)-4-thiophen-3-ylbutyl]cyclopropanamine
CID 79441057
2-(3-fluorophenyl)-4-methyl-N-(2-methylpropyl)hexan-1-amine
CID 79440359
N-[2-(3-fluorophenoxy)pentyl]cyclopropanamine
CID 83043805
N-[2-(3-fluorophenyl)-3-(1-methyltriazol-4-yl)propyl]cyclopropanamine
CID 107053416

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine?
The IUPAC name of N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine (CID 79440904) is N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine.
What is the SMILES notation for N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine?
The canonical SMILES for N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine is CCCC(C)CC(CNC1CC1)c1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine?
The InChIKey is OFANWQOHKBLERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN/c1-3-5-13(2)10-15(12-19-17-8-9-17)14-6-4-7-16(18)11-14/h4,6-7,11,13,15,17,19H,3,5,8-10,12H2,1-2H3.
What are the key properties of N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine?
N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine has a molecular weight of 263.40 g/mol, XLogP of 4.49, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)-4-methylheptyl]cyclopropanamine is sourced from PubChem (CID 79440904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).