2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine

C14H22N2 — CID 64908416

IUPAC2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
SMILESCC(NC1CCC(C)C1C)c1ccccn1
InChIInChI=1S/C14H22N2/c1-10-7-8-13(11(10)2)16-12(3)14-6-4-5-9-15-14/h4-6,9-13,16H,7-8H2,1-3H3
InChIKeyXOWGKRKMRFCPAK-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.17
Rot. Bonds3

About 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine

2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine (PubChem CID 64908416) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
PubChem CID64908416
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
SMILESCC(NC1CCC(C)C1C)c1ccccn1
InChIInChI=1S/C14H22N2/c1-10-7-8-13(11(10)2)16-12(3)14-6-4-5-9-15-14/h4-6,9-13,16H,7-8H2,1-3H3
InChIKeyXOWGKRKMRFCPAK-UHFFFAOYSA-N
XLogP3.17
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine?
The IUPAC name of 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine (CID 64908416) is 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine is CC(NC1CCC(C)C1C)c1ccccn1.
What is the InChIKey of 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine?
The InChIKey is XOWGKRKMRFCPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-10-7-8-13(11(10)2)16-12(3)14-6-4-5-9-15-14/h4-6,9-13,16H,7-8H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine?
2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine has a molecular weight of 218.34 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine is sourced from PubChem (CID 64908416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).