2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine

C13H23N — CID 115908602

IUPAC2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine
SMILESC1=C(CCNCC2CCCC2)CCC1
InChIInChI=1S/C13H23N/c1-2-6-12(5-1)9-10-14-11-13-7-3-4-8-13/h5,13-14H,1-4,6-11H2
InChIKeyQYILHMJNAXVCPC-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.27
Rot. Bonds5

About 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine

2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine (PubChem CID 115908602) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine.

Molecular Properties

Compound Name2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine
PubChem CID115908602
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine
SMILESC1=C(CCNCC2CCCC2)CCC1
InChIInChI=1S/C13H23N/c1-2-6-12(5-1)9-10-14-11-13-7-3-4-8-13/h5,13-14H,1-4,6-11H2
InChIKeyQYILHMJNAXVCPC-UHFFFAOYSA-N
XLogP3.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine
CID 115762872
2-(cyclohexen-1-yl)-N-(oxan-4-ylmethyl)ethanamine
CID 62387139
N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine
CID 115762884
N-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylacetamide
CID 848109
1-[2-(cyclopenten-1-yl)ethylamino]-3-(cyclopropylmethoxy)propan-2-ol
CID 106174220
[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-cyclopentylacetate
CID 55313986
3-[2-(cyclopenten-1-yl)ethylamino]propanoic acid
CID 106173967
1-(cyclobutylmethyl)-3-[2-(cyclohexen-1-yl)ethyl]-2-methylguanidine
CID 119130796
(2S)-1-[2-(cyclopenten-1-yl)ethylamino]propan-2-ol
CID 106174090
2-[2-(cyclopenten-1-yl)ethylamino]-N-methylacetamide
CID 106173871
1-(3-cyclobutylpropyl)cyclopentene
CID 147990269
N-[2-(cyclopenten-1-yl)ethyl]-3-(2-methoxyethoxy)propan-1-amine
CID 106174186

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine?
The IUPAC name of 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine (CID 115908602) is 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine.
What is the SMILES notation for 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine?
The canonical SMILES for 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine is C1=C(CCNCC2CCCC2)CCC1.
What is the InChIKey of 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine?
The InChIKey is QYILHMJNAXVCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-2-6-12(5-1)9-10-14-11-13-7-3-4-8-13/h5,13-14H,1-4,6-11H2.
What are the key properties of 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine?
2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine has a molecular weight of 193.33 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine is sourced from PubChem (CID 115908602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).