1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine

C14H25N — CID 65415557

IUPAC1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine
SMILESCC#CCC(NC)C1CCCC(CC)C1
InChIInChI=1S/C14H25N/c1-4-6-10-14(15-3)13-9-7-8-12(5-2)11-13/h12-15H,5,7-11H2,1-3H3
InChIKeyQYHQPZQVLZZTCB-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.20
Rot. Bonds4

About 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine

1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine (PubChem CID 65415557) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine
PubChem CID65415557
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine
SMILESCC#CCC(NC)C1CCCC(CC)C1
InChIInChI=1S/C14H25N/c1-4-6-10-14(15-3)13-9-7-8-12(5-2)11-13/h12-15H,5,7-11H2,1-3H3
InChIKeyQYHQPZQVLZZTCB-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(3-ethylcyclopentyl)-N-propylpent-3-yn-1-amine
CID 65411828
1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine
CID 105156121
N-ethyl-1-(3-ethylcyclohexyl)but-3-yn-1-amine
CID 65412723
1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine
CID 65414544
1-cyclobutyl-N-ethylpent-3-yn-1-amine
CID 64986404
1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
CID 65394157
1-cyclobutyl-N-methylhex-4-yn-1-amine
CID 104805821
1-(3-ethylcyclohexyl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 65422358
[2-cyclobutyl-1-(3-ethylcyclopentyl)ethyl]hydrazine
CID 105233567
1-(2,2-dimethylcyclopropyl)-1-(3-ethylcyclohexyl)-N-methylmethanamine
CID 107004575
1-[3-(2-cycloheptylethyl)cyclohexyl]-N-methylbutan-1-amine
CID 170003941
1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
CID 79761386

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine?
The IUPAC name of 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine (CID 65415557) is 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine is CC#CCC(NC)C1CCCC(CC)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine?
The InChIKey is QYHQPZQVLZZTCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-4-6-10-14(15-3)13-9-7-8-12(5-2)11-13/h12-15H,5,7-11H2,1-3H3.
What are the key properties of 1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine?
1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine has a molecular weight of 207.36 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-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine is sourced from PubChem (CID 65415557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).