1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine

C14H27N — CID 105004573

IUPAC1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine
SMILESCCNC(C=C(C)C)CC1CCCCC1
InChIInChI=1S/C14H27N/c1-4-15-14(10-12(2)3)11-13-8-6-5-7-9-13/h10,13-15H,4-9,11H2,1-3H3
InChIKeyCMOMZVYXDBRLNW-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.90
Rot. Bonds5

About 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine

1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine (PubChem CID 105004573) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine
PubChem CID105004573
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine
SMILESCCNC(C=C(C)C)CC1CCCCC1
InChIInChI=1S/C14H27N/c1-4-15-14(10-12(2)3)11-13-8-6-5-7-9-13/h10,13-15H,4-9,11H2,1-3H3
InChIKeyCMOMZVYXDBRLNW-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-5-methylhex-4-en-3-amine
CID 79190287
1-cycloheptyl-N-ethyl-3-methylbut-3-en-2-amine
CID 105005423
1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine
CID 104986481
1,3-dicyclopentyl-N-ethylpropan-2-amine
CID 115847226
1-cycloheptyl-2-cyclohexyl-N-ethylethanamine
CID 65399491
1,2-di(cycloheptyl)-N-ethylethanamine
CID 105027799
N-ethyl-1-(3-ethylcyclohexyl)-3-methylbut-2-en-1-amine
CID 79180441
1-cyclobutyl-3-cyclopentyl-N-ethylpropan-2-amine
CID 115863503
1-cycloheptyl-N-ethyl-5-methylhex-5-en-2-amine
CID 105039575
1-cyclohexyl-N-ethyl-3-methylhexan-2-amine
CID 115842188
1-cyclopentyl-N-ethyl-3-methoxy-3-methylbutan-2-amine
CID 79197910
1-cyclohexyl-3-ethoxy-N-ethylpentan-2-amine
CID 116717017

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine?
The IUPAC name of 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine (CID 105004573) is 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine?
The canonical SMILES for 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine is CCNC(C=C(C)C)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine?
The InChIKey is CMOMZVYXDBRLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-4-15-14(10-12(2)3)11-13-8-6-5-7-9-13/h10,13-15H,4-9,11H2,1-3H3.
What are the key properties of 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine?
1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine has a molecular weight of 209.38 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethyl-4-methylpent-3-en-2-amine is sourced from PubChem (CID 105004573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).