5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine

C13H15N3 — CID 63306403

IUPAC5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine
SMILESCc1ccc(NCc2ncccc2C)nc1
InChIInChI=1S/C13H15N3/c1-10-5-6-13(15-8-10)16-9-12-11(2)4-3-7-14-12/h3-8H,9H2,1-2H3,(H,15,16)
InChIKeyPUSRZUHKABLMBU-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.71
Rot. Bonds3

About 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine

5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine (PubChem CID 63306403) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine
PubChem CID63306403
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine
SMILESCc1ccc(NCc2ncccc2C)nc1
InChIInChI=1S/C13H15N3/c1-10-5-6-13(15-8-10)16-9-12-11(2)4-3-7-14-12/h3-8H,9H2,1-2H3,(H,15,16)
InChIKeyPUSRZUHKABLMBU-UHFFFAOYSA-N
XLogP2.71
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine?
The IUPAC name of 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine (CID 63306403) is 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine?
The canonical SMILES for 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine is Cc1ccc(NCc2ncccc2C)nc1.
What is the InChIKey of 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine?
The InChIKey is PUSRZUHKABLMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10-5-6-13(15-8-10)16-9-12-11(2)4-3-7-14-12/h3-8H,9H2,1-2H3,(H,15,16).
What are the key properties of 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine?
5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine has a molecular weight of 213.28 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine is sourced from PubChem (CID 63306403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).