N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine

C14H23N — CID 115762884

IUPACN-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine
SMILESC1=CCC(CNCCC2=CCCC2)CC1
InChIInChI=1S/C14H23N/c1-2-8-14(9-3-1)12-15-11-10-13-6-4-5-7-13/h1-2,6,14-15H,3-5,7-12H2
InChIKeyOZBQTOJLLCDGGM-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.43
Rot. Bonds5

About N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine

N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine (PubChem CID 115762884) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine.

Molecular Properties

Compound NameN-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine
PubChem CID115762884
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine
SMILESC1=CCC(CNCCC2=CCCC2)CC1
InChIInChI=1S/C14H23N/c1-2-8-14(9-3-1)12-15-11-10-13-6-4-5-7-13/h1-2,6,14-15H,3-5,7-12H2
InChIKeyOZBQTOJLLCDGGM-UHFFFAOYSA-N
XLogP3.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.43
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
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-(3-methylphenyl)ethanamine
CID 55062661
N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine
CID 43215811
N-(cyclohex-3-en-1-ylmethyl)-2-(4-methoxyphenyl)ethanamine
CID 4792508
3-[2-(cyclopenten-1-yl)ethylamino]propanoic acid
CID 106173967
(2S)-1-[2-(cyclopenten-1-yl)ethylamino]propan-2-ol
CID 106174090
1-[2-(cyclopenten-1-yl)ethylamino]-3-(cyclopropylmethoxy)propan-2-ol
CID 106174220
N-(cyclohex-3-en-1-ylmethyl)-3-cyclohexyloxypropan-1-amine
CID 43081150
N-(cyclohex-3-en-1-ylmethyl)-N',N'-dimethylpropane-1,3-diamine
CID 43180683
2-[2-(cyclopenten-1-yl)ethylamino]-N-methylacetamide
CID 106173871

Frequently Asked Questions

What is the IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine?
The IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine (CID 115762884) is N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine.
What is the SMILES notation for N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine?
The canonical SMILES for N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine is C1=CCC(CNCCC2=CCCC2)CC1.
What is the InChIKey of N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine?
The InChIKey is OZBQTOJLLCDGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-8-14(9-3-1)12-15-11-10-13-6-4-5-7-13/h1-2,6,14-15H,3-5,7-12H2.
What are the key properties of N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine?
N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine has a molecular weight of 205.34 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohex-3-en-1-ylmethyl)-2-(cyclopenten-1-yl)ethanamine is sourced from PubChem (CID 115762884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).