3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine

C17H27N — CID 43484696

IUPAC3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine
SMILESCCc1ccc(C(CCC2CCCC2)NC)cc1
InChIInChI=1S/C17H27N/c1-3-14-8-11-16(12-9-14)17(18-2)13-10-15-6-4-5-7-15/h8-9,11-12,15,17-18H,3-7,10,13H2,1-2H3
InChIKeyRRNGHSWYVVOFSB-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.48
Rot. Bonds6

About 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine

3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine (PubChem CID 43484696) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine
PubChem CID43484696
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine
SMILESCCc1ccc(C(CCC2CCCC2)NC)cc1
InChIInChI=1S/C17H27N/c1-3-14-8-11-16(12-9-14)17(18-2)13-10-15-6-4-5-7-15/h8-9,11-12,15,17-18H,3-7,10,13H2,1-2H3
InChIKeyRRNGHSWYVVOFSB-UHFFFAOYSA-N
XLogP4.48
TPSA12.03 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 ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cycloheptyl-1-(4-ethylphenyl)-N-methylethanamine
CID 114457545
3-cyclopentyl-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-amine
CID 43480658
N'-(cyclohexylmethyl)-1-(4-ethylphenyl)-N,N'-dimethylethane-1,2-diamine
CID 63468506
3-cyclopentyl-1-(5-ethylfuran-2-yl)-N-methylpropan-1-amine
CID 62346393
N-(2-cyclopentylethyl)-1-(4-ethylphenyl)ethanamine
CID 63450481
2-cyclopentyl-N-methyl-1-(4-propylphenyl)ethanamine
CID 60771358
1-(4-ethylphenyl)-N,5-dimethylhexan-1-amine
CID 83161767
4-(4-ethylphenyl)-4-(methylamino)butanoic acid
CID 112517844
1-(4-ethylphenyl)-1-N,4-dimethylpentane-1,4-diamine
CID 116950168
3-cyclopentyl-1-(3,3-dimethyl-2H-1-benzofuran-5-yl)-N-methylpropan-1-amine
CID 107293631
2-cyclobutyloxy-1-(4-ethylphenyl)-N-methylethanamine
CID 62139676
3-cyclohexyl-N-methyl-1-[3-(2-methylpropyl)phenyl]propan-1-amine
CID 105050635

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine (CID 43484696) is 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine is CCc1ccc(C(CCC2CCCC2)NC)cc1.
What is the InChIKey of 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine?
The InChIKey is RRNGHSWYVVOFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-3-14-8-11-16(12-9-14)17(18-2)13-10-15-6-4-5-7-15/h8-9,11-12,15,17-18H,3-7,10,13H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine?
3-cyclopentyl-1-(4-ethylphenyl)-N-methylpropan-1-amine has a molecular weight of 245.41 g/mol, XLogP of 4.48, 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-ethylphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 43484696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).