N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine

C16H22FN — CID 113384039

IUPACN-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine
SMILESCC(CNC1CC(c2ccccc2F)C1)C1CC1
InChIInChI=1S/C16H22FN/c1-11(12-6-7-12)10-18-14-8-13(9-14)15-4-2-3-5-16(15)17/h2-5,11-14,18H,6-10H2,1H3
InChIKeyPPPCVICKKXSQJR-UHFFFAOYSA-N
MW247.36 g/mol
LogP3.71
Rot. Bonds5

About N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine

N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine (PubChem CID 113384039) has the molecular formula C16H22FN and a molecular weight of 247.36 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine
PubChem CID113384039
Molecular FormulaC16H22FN
Molecular Weight247.36 g/mol
Exact Mass247.17
IUPAC NameN-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine
SMILESCC(CNC1CC(c2ccccc2F)C1)C1CC1
InChIInChI=1S/C16H22FN/c1-11(12-6-7-12)10-18-14-8-13(9-14)15-4-2-3-5-16(15)17/h2-5,11-14,18H,6-10H2,1H3
InChIKeyPPPCVICKKXSQJR-UHFFFAOYSA-N
XLogP3.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-fluorophenyl)-N-(2-phenylpropyl)cyclobutan-1-amine
CID 43634457
N-(2-ethylhexyl)-3-(2-fluorophenyl)cyclobutan-1-amine
CID 43634228
3-(2-fluorophenyl)-N-(7-methyloctyl)cyclobutan-1-amine
CID 43634781
1-[[3-(2-fluorophenyl)cyclobutyl]amino]-2,4-dimethylpentan-2-ol
CID 66181283
N-(cyclohexylmethyl)-3-(2-fluorophenyl)cyclobutan-1-amine
CID 43635354
N-(3-ethoxypropyl)-3-(2-fluorophenyl)cyclobutan-1-amine
CID 43633919
1-[[3-(2-fluorophenyl)cyclobutyl]amino]-2-methylbutan-2-ol
CID 65107731
1-fluoro-2-(3-propan-2-ylcyclohexyl)benzene
CID 135179101
N-[3-(2-fluorophenyl)cyclobutyl]-1-propan-2-ylpiperidin-4-amine
CID 43634682
N-(2-cyclopropylpropyl)-3,4-dihydro-2H-chromen-4-amine
CID 115713897
3-[[3-(2-fluorophenyl)cyclobutyl]amino]butanamide
CID 115676927
N-[3-(2-fluorophenyl)cyclobutyl]cyclooctanamine
CID 43633190

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine?
The IUPAC name of N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine (CID 113384039) is N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine.
What is the SMILES notation for N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine?
The canonical SMILES for N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine is CC(CNC1CC(c2ccccc2F)C1)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine?
The InChIKey is PPPCVICKKXSQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FN/c1-11(12-6-7-12)10-18-14-8-13(9-14)15-4-2-3-5-16(15)17/h2-5,11-14,18H,6-10H2,1H3.
What are the key properties of N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine?
N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine has a molecular weight of 247.36 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-3-(2-fluorophenyl)cyclobutan-1-amine is sourced from PubChem (CID 113384039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).