2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine

C15H24N2 — CID 80709898

IUPAC2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine
SMILESCc1ccc(CNC2CCC(C)CC2C)nc1
InChIInChI=1S/C15H24N2/c1-11-5-7-15(13(3)8-11)17-10-14-6-4-12(2)9-16-14/h4,6,9,11,13,15,17H,5,7-8,10H2,1-3H3
InChIKeySGADHGAOCUUPOW-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.30
Rot. Bonds3

About 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine

2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine (PubChem CID 80709898) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine
PubChem CID80709898
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine
SMILESCc1ccc(CNC2CCC(C)CC2C)nc1
InChIInChI=1S/C15H24N2/c1-11-5-7-15(13(3)8-11)17-10-14-6-4-12(2)9-16-14/h4,6,9,11,13,15,17H,5,7-8,10H2,1-3H3
InChIKeySGADHGAOCUUPOW-UHFFFAOYSA-N
XLogP3.30
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine?
The IUPAC name of 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine (CID 80709898) is 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine is Cc1ccc(CNC2CCC(C)CC2C)nc1.
What is the InChIKey of 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine?
The InChIKey is SGADHGAOCUUPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-5-7-15(13(3)8-11)17-10-14-6-4-12(2)9-16-14/h4,6,9,11,13,15,17H,5,7-8,10H2,1-3H3.
What are the key properties of 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine?
2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 80709898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).