N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine

C14H27N — CID 58662071

IUPACN-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine
SMILESCCN(C1CCCC1)C1CCC(C)CC1
InChIInChI=1S/C14H27N/c1-3-15(13-6-4-5-7-13)14-10-8-12(2)9-11-14/h12-14H,3-11H2,1-2H3
InChIKeyYYQYDJFZSVSMFI-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.83
Rot. Bonds3

About N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine

N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine (PubChem CID 58662071) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine
PubChem CID58662071
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine
SMILESCCN(C1CCCC1)C1CCC(C)CC1
InChIInChI=1S/C14H27N/c1-3-15(13-6-4-5-7-13)14-10-8-12(2)9-11-14/h12-14H,3-11H2,1-2H3
InChIKeyYYQYDJFZSVSMFI-UHFFFAOYSA-N
XLogP3.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine?
The IUPAC name of N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine (CID 58662071) is N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine.
What is the SMILES notation for N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine?
The canonical SMILES for N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine is CCN(C1CCCC1)C1CCC(C)CC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine?
The InChIKey is YYQYDJFZSVSMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-3-15(13-6-4-5-7-13)14-10-8-12(2)9-11-14/h12-14H,3-11H2,1-2H3.
What are the key properties of N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine?
N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine has a molecular weight of 209.38 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine is sourced from PubChem (CID 58662071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).