1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine

C15H24N2 — CID 115854871

IUPAC1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
SMILESCCC1(C(NC)c2ccc(C)nc2)CCCC1
InChIInChI=1S/C15H24N2/c1-4-15(9-5-6-10-15)14(16-3)13-8-7-12(2)17-11-13/h7-8,11,14,16H,4-6,9-10H2,1-3H3
InChIKeyAGFLYYZUEISMGW-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.62
Rot. Bonds4

About 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine

1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine (PubChem CID 115854871) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
PubChem CID115854871
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
SMILESCCC1(C(NC)c2ccc(C)nc2)CCCC1
InChIInChI=1S/C15H24N2/c1-4-15(9-5-6-10-15)14(16-3)13-8-7-12(2)17-11-13/h7-8,11,14,16H,4-6,9-10H2,1-3H3
InChIKeyAGFLYYZUEISMGW-UHFFFAOYSA-N
XLogP3.62
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 ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
The IUPAC name of 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine (CID 115854871) is 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
The canonical SMILES for 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine is CCC1(C(NC)c2ccc(C)nc2)CCCC1.
What is the InChIKey of 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
The InChIKey is AGFLYYZUEISMGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-15(9-5-6-10-15)14(16-3)13-8-7-12(2)17-11-13/h7-8,11,14,16H,4-6,9-10H2,1-3H3.
What are the key properties of 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine has a molecular weight of 232.37 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 115854871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).