2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine

C12H13N3 — CID 75356077

IUPAC2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine
SMILESCc1ncccc1NCc1cccnc1
InChIInChI=1S/C12H13N3/c1-10-12(5-3-7-14-10)15-9-11-4-2-6-13-8-11/h2-8,15H,9H2,1H3
InChIKeyNUCBTBOLZWEJGE-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.40
Rot. Bonds3

About 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine

2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine (PubChem CID 75356077) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine
PubChem CID75356077
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine
SMILESCc1ncccc1NCc1cccnc1
InChIInChI=1S/C12H13N3/c1-10-12(5-3-7-14-10)15-9-11-4-2-6-13-8-11/h2-8,15H,9H2,1H3
InChIKeyNUCBTBOLZWEJGE-UHFFFAOYSA-N
XLogP2.40
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine?
The IUPAC name of 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine (CID 75356077) is 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine?
The canonical SMILES for 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine is Cc1ncccc1NCc1cccnc1.
What is the InChIKey of 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine?
The InChIKey is NUCBTBOLZWEJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-10-12(5-3-7-14-10)15-9-11-4-2-6-13-8-11/h2-8,15H,9H2,1H3.
What are the key properties of 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine?
2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine has a molecular weight of 199.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 75356077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).