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

C14H25N — CID 115762872

IUPACN-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine
SMILESC1=C(CCNCC2CCCCC2)CCC1
InChIInChI=1S/C14H25N/c1-2-8-14(9-3-1)12-15-11-10-13-6-4-5-7-13/h6,14-15H,1-5,7-12H2
InChIKeyLOUYXGRDYICSPK-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.66
Rot. Bonds5

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

N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine (PubChem CID 115762872) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine
PubChem CID115762872
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine
SMILESC1=C(CCNCC2CCCCC2)CCC1
InChIInChI=1S/C14H25N/c1-2-8-14(9-3-1)12-15-11-10-13-6-4-5-7-13/h6,14-15H,1-5,7-12H2
InChIKeyLOUYXGRDYICSPK-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.66
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

2-(cyclopenten-1-yl)-N-(cyclopentylmethyl)ethanamine
CID 115908602
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-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine
CID 106169105
2-[2-(cyclopenten-1-yl)ethylamino]-N-methylacetamide
CID 106173871
1-(3-cyclobutylpropyl)cyclopentene
CID 147990269

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine?
The IUPAC name of N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine (CID 115762872) is N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine.
What is the SMILES notation for N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine?
The canonical SMILES for N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine is C1=C(CCNCC2CCCCC2)CCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine?
The InChIKey is LOUYXGRDYICSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-2-8-14(9-3-1)12-15-11-10-13-6-4-5-7-13/h6,14-15H,1-5,7-12H2.
What are the key properties of N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine?
N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine has a molecular weight of 207.36 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine is sourced from PubChem (CID 115762872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).