N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine

C15H18N2 — CID 59308598

IUPACN-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine
SMILESCc1ccc(N(c2ccccn2)C(C)C)cc1
InChIInChI=1S/C15H18N2/c1-12(2)17(15-6-4-5-11-16-15)14-9-7-13(3)8-10-14/h4-12H,1-3H3
InChIKeyXBVAKETVOHYOPQ-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.94
Rot. Bonds3

About N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine

N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine (PubChem CID 59308598) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine
PubChem CID59308598
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine
SMILESCc1ccc(N(c2ccccn2)C(C)C)cc1
InChIInChI=1S/C15H18N2/c1-12(2)17(15-6-4-5-11-16-15)14-9-7-13(3)8-10-14/h4-12H,1-3H3
InChIKeyXBVAKETVOHYOPQ-UHFFFAOYSA-N
XLogP3.94
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine (CID 59308598) is N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine is Cc1ccc(N(c2ccccn2)C(C)C)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is XBVAKETVOHYOPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-12(2)17(15-6-4-5-11-16-15)14-9-7-13(3)8-10-14/h4-12H,1-3H3.
What are the key properties of N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine?
N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 226.32 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 59308598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).