3-cyclopentyl-1-(4-propylphenyl)propan-1-amine

C17H27N — CID 43106075

IUPAC3-cyclopentyl-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(N)CCC2CCCC2)cc1
InChIInChI=1S/C17H27N/c1-2-5-14-8-11-16(12-9-14)17(18)13-10-15-6-3-4-7-15/h8-9,11-12,15,17H,2-7,10,13,18H2,1H3
InChIKeyPUIHDPVVTRNDRT-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.61
Rot. Bonds6

About 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine

3-cyclopentyl-1-(4-propylphenyl)propan-1-amine (PubChem CID 43106075) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(4-propylphenyl)propan-1-amine
PubChem CID43106075
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name3-cyclopentyl-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(N)CCC2CCCC2)cc1
InChIInChI=1S/C17H27N/c1-2-5-14-8-11-16(12-9-14)17(18)13-10-15-6-3-4-7-15/h8-9,11-12,15,17H,2-7,10,13,18H2,1H3
InChIKeyPUIHDPVVTRNDRT-UHFFFAOYSA-N
XLogP4.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-cyclopentyl-1-(4-propan-2-ylphenyl)propan-1-amine
CID 43625227
1-(4-tert-butylphenyl)-3-cyclopentylpropan-1-amine
CID 43110325
1-(4-bromophenyl)-3-cyclopentylpropan-1-amine
CID 43184859
2-(cyclopentylmethylsulfonyl)-1-(4-propylphenyl)ethanamine
CID 64675916
3-cyclohexyl-1-phenylpropan-1-amine
CID 43110402
N'-cyclohexyl-N'-methyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43099891
1-butyl-4-(1-chloro-3-cyclohexylpropyl)benzene
CID 63431518
1-(4-butylphenyl)-3-(oxan-2-yl)propan-1-amine
CID 63952731
N'-cyclopentyl-N'-ethyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43541052
2-cyclobutyloxy-1-(4-propylphenyl)ethanamine
CID 62139683
1-(4-propylphenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83052836
3-propoxy-1-(4-propylphenyl)propan-1-amine
CID 105144351

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine (CID 43106075) is 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine is CCCc1ccc(C(N)CCC2CCCC2)cc1.
What is the InChIKey of 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine?
The InChIKey is PUIHDPVVTRNDRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-2-5-14-8-11-16(12-9-14)17(18)13-10-15-6-3-4-7-15/h8-9,11-12,15,17H,2-7,10,13,18H2,1H3.
What are the key properties of 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine?
3-cyclopentyl-1-(4-propylphenyl)propan-1-amine has a molecular weight of 245.41 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(4-propylphenyl)propan-1-amine is sourced from PubChem (CID 43106075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).