1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine

C12H25N — CID 79863310

IUPAC1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine
SMILESCCNC(CC)C1CCCC1(C)C
InChIInChI=1S/C12H25N/c1-5-11(13-6-2)10-8-7-9-12(10,3)4/h10-11,13H,5-9H2,1-4H3
InChIKeySZMDLPIXWPNILP-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds4

About 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine

1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine (PubChem CID 79863310) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine.

Molecular Properties

Compound Name1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine
PubChem CID79863310
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine
SMILESCCNC(CC)C1CCCC1(C)C
InChIInChI=1S/C12H25N/c1-5-11(13-6-2)10-8-7-9-12(10,3)4/h10-11,13H,5-9H2,1-4H3
InChIKeySZMDLPIXWPNILP-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2-dimethylcyclopentyl)-N-ethyl-3-methylbutan-1-amine
CID 107187753
1-(2,2-dimethylcyclopentyl)-N-ethyl-3-methylbut-3-en-1-amine
CID 107189744
1-(2,2-dimethylcyclohexyl)-N-methylpropan-1-amine
CID 79852591
1-(2,2-dimethylcyclopentyl)-N,3-diethylheptan-1-amine
CID 107187925
2-cyclohexyl-1-(2,2-dimethylcyclohexyl)-N-ethylethanamine
CID 107188282
2-(2,6-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)-N-ethylethanamine
CID 107188128
1-(2,2-dimethylcyclohexyl)-N-ethylhex-5-en-1-amine
CID 107189124
1-(2,2-dimethylcyclopentyl)-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 107179538
2-(2,5-difluorophenyl)-1-(2,2-dimethylcyclopentyl)-N-ethylethanamine
CID 107187954
2-(2-chloro-4-fluorophenyl)-1-(2,2-dimethylcyclopentyl)-N-ethylethanamine
CID 107188245
2-(2-chloro-6-fluorophenyl)-1-(2,2-dimethylcyclopentyl)-N-ethylethanamine
CID 107179470
N-[(2,2-dimethylcyclopentyl)-(4-ethylcyclohexyl)methyl]ethanamine
CID 107189244

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine?
The IUPAC name of 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine (CID 79863310) is 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine.
What is the SMILES notation for 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine?
The canonical SMILES for 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine is CCNC(CC)C1CCCC1(C)C.
What is the InChIKey of 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine?
The InChIKey is SZMDLPIXWPNILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-5-11(13-6-2)10-8-7-9-12(10,3)4/h10-11,13H,5-9H2,1-4H3.
What are the key properties of 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine?
1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclopentyl)-N-ethylpropan-1-amine is sourced from PubChem (CID 79863310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).