3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine

C15H24N2 — CID 66272337

IUPAC3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCCC(c2cnccc2C)C1
InChIInChI=1S/C15H24N2/c1-3-8-17-14-6-4-5-13(10-14)15-11-16-9-7-12(15)2/h7,9,11,13-14,17H,3-6,8,10H2,1-2H3
InChIKeyDAQOITLDHIOMDB-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.42
Rot. Bonds4

About 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine

3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine (PubChem CID 66272337) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine
PubChem CID66272337
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCCC(c2cnccc2C)C1
InChIInChI=1S/C15H24N2/c1-3-8-17-14-6-4-5-13(10-14)15-11-16-9-7-12(15)2/h7,9,11,13-14,17H,3-6,8,10H2,1-2H3
InChIKeyDAQOITLDHIOMDB-UHFFFAOYSA-N
XLogP3.42
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 ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine?
The IUPAC name of 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine (CID 66272337) is 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine.
What is the SMILES notation for 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine?
The canonical SMILES for 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine is CCCNC1CCCC(c2cnccc2C)C1.
What is the InChIKey of 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine?
The InChIKey is DAQOITLDHIOMDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-8-17-14-6-4-5-13(10-14)15-11-16-9-7-12(15)2/h7,9,11,13-14,17H,3-6,8,10H2,1-2H3.
What are the key properties of 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine?
3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-3-pyridinyl)-N-propylcyclohexan-1-amine is sourced from PubChem (CID 66272337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).