3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine

C15H24N2 — CID 64723808

IUPAC3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine
SMILESCC1CC(C)CC(NC(C)c2ccccn2)C1
InChIInChI=1S/C15H24N2/c1-11-8-12(2)10-14(9-11)17-13(3)15-6-4-5-7-16-15/h4-7,11-14,17H,8-10H2,1-3H3
InChIKeyBNCDZYFSIJNFKN-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.56
Rot. Bonds3

About 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine

3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine (PubChem CID 64723808) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine
PubChem CID64723808
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine
SMILESCC1CC(C)CC(NC(C)c2ccccn2)C1
InChIInChI=1S/C15H24N2/c1-11-8-12(2)10-14(9-11)17-13(3)15-6-4-5-7-16-15/h4-7,11-14,17H,8-10H2,1-3H3
InChIKeyBNCDZYFSIJNFKN-UHFFFAOYSA-N
XLogP3.56
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 ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine (CID 64723808) is 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine is CC1CC(C)CC(NC(C)c2ccccn2)C1.
What is the InChIKey of 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine?
The InChIKey is BNCDZYFSIJNFKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-8-12(2)10-14(9-11)17-13(3)15-6-4-5-7-16-15/h4-7,11-14,17H,8-10H2,1-3H3.
What are the key properties of 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine?
3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 64723808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).