5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine

C18H22N2 — CID 107584855

IUPAC5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine
SMILESCc1cncc(NC2CCC(c3ccccc3)CC2)c1
InChIInChI=1S/C18H22N2/c1-14-11-18(13-19-12-14)20-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-6,11-13,16-17,20H,7-10H2,1H3
InChIKeyZLFZWBPBYWXYCK-UHFFFAOYSA-N
MW266.39 g/mol
LogP4.53
Rot. Bonds3

About 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine

5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine (PubChem CID 107584855) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine
PubChem CID107584855
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine
SMILESCc1cncc(NC2CCC(c3ccccc3)CC2)c1
InChIInChI=1S/C18H22N2/c1-14-11-18(13-19-12-14)20-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-6,11-13,16-17,20H,7-10H2,1H3
InChIKeyZLFZWBPBYWXYCK-UHFFFAOYSA-N
XLogP4.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine?
The IUPAC name of 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine (CID 107584855) is 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine?
The canonical SMILES for 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine is Cc1cncc(NC2CCC(c3ccccc3)CC2)c1.
What is the InChIKey of 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine?
The InChIKey is ZLFZWBPBYWXYCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-14-11-18(13-19-12-14)20-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-6,11-13,16-17,20H,7-10H2,1H3.
What are the key properties of 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine?
5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine has a molecular weight of 266.39 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-phenylcyclohexyl)pyridin-3-amine is sourced from PubChem (CID 107584855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).