3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine

C15H24N2 — CID 112650199

IUPAC3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(NCc2ncccc2C)C1C
InChIInChI=1S/C15H24N2/c1-4-13-7-8-14(12(13)3)17-10-15-11(2)6-5-9-16-15/h5-6,9,12-14,17H,4,7-8,10H2,1-3H3
InChIKeyZQQSEPOIBFUSSN-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.30
Rot. Bonds4

About 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine

3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine (PubChem CID 112650199) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine
PubChem CID112650199
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(NCc2ncccc2C)C1C
InChIInChI=1S/C15H24N2/c1-4-13-7-8-14(12(13)3)17-10-15-11(2)6-5-9-16-15/h5-6,9,12-14,17H,4,7-8,10H2,1-3H3
InChIKeyZQQSEPOIBFUSSN-UHFFFAOYSA-N
XLogP3.30
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine (CID 112650199) is 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine is CCC1CCC(NCc2ncccc2C)C1C.
What is the InChIKey of 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine?
The InChIKey is ZQQSEPOIBFUSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-13-7-8-14(12(13)3)17-10-15-11(2)6-5-9-16-15/h5-6,9,12-14,17H,4,7-8,10H2,1-3H3.
What are the key properties of 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine?
3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 112650199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).