5-(3-ethylcyclopentyl)-N-methylpentan-2-amine

C13H27N — CID 166803719

IUPAC5-(3-ethylcyclopentyl)-N-methylpentan-2-amine
SMILESCCC1CCC(CCCC(C)NC)C1
InChIInChI=1S/C13H27N/c1-4-12-8-9-13(10-12)7-5-6-11(2)14-3/h11-14H,4-10H2,1-3H3
InChIKeySPDLYKKOXCZNHT-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.59
Rot. Bonds6

About 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine

5-(3-ethylcyclopentyl)-N-methylpentan-2-amine (PubChem CID 166803719) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine.

Molecular Properties

Compound Name5-(3-ethylcyclopentyl)-N-methylpentan-2-amine
PubChem CID166803719
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name5-(3-ethylcyclopentyl)-N-methylpentan-2-amine
SMILESCCC1CCC(CCCC(C)NC)C1
InChIInChI=1S/C13H27N/c1-4-12-8-9-13(10-12)7-5-6-11(2)14-3/h11-14H,4-10H2,1-3H3
InChIKeySPDLYKKOXCZNHT-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine?
The IUPAC name of 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine (CID 166803719) is 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine.
What is the SMILES notation for 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine?
The canonical SMILES for 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine is CCC1CCC(CCCC(C)NC)C1.
What is the InChIKey of 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine?
The InChIKey is SPDLYKKOXCZNHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-4-12-8-9-13(10-12)7-5-6-11(2)14-3/h11-14H,4-10H2,1-3H3.
What are the key properties of 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine?
5-(3-ethylcyclopentyl)-N-methylpentan-2-amine has a molecular weight of 197.37 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethylcyclopentyl)-N-methylpentan-2-amine is sourced from PubChem (CID 166803719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).