N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine

C12H13N3 — CID 102824841

IUPACN-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine
SMILESCNc1ccnc(-c2cnccc2C)c1
InChIInChI=1S/C12H13N3/c1-9-3-5-14-8-11(9)12-7-10(13-2)4-6-15-12/h3-8H,1-2H3,(H,13,15)
InChIKeyCOQBNXCWRLJSCP-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.49
Rot. Bonds2

About N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine

N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine (PubChem CID 102824841) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine
PubChem CID102824841
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC NameN-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine
SMILESCNc1ccnc(-c2cnccc2C)c1
InChIInChI=1S/C12H13N3/c1-9-3-5-14-8-11(9)12-7-10(13-2)4-6-15-12/h3-8H,1-2H3,(H,13,15)
InChIKeyCOQBNXCWRLJSCP-UHFFFAOYSA-N
XLogP2.49
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine?
The IUPAC name of N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine (CID 102824841) is N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine.
What is the SMILES notation for N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine?
The canonical SMILES for N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine is CNc1ccnc(-c2cnccc2C)c1.
What is the InChIKey of N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine?
The InChIKey is COQBNXCWRLJSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-9-3-5-14-8-11(9)12-7-10(13-2)4-6-15-12/h3-8H,1-2H3,(H,13,15).
What are the key properties of N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine?
N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine has a molecular weight of 199.26 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methyl-3-pyridinyl)pyridin-4-amine is sourced from PubChem (CID 102824841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).