5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine

C11H14N4 — CID 63295615

IUPAC5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
SMILESCc1ccc(NCc2nccn2C)nc1
InChIInChI=1S/C11H14N4/c1-9-3-4-10(13-7-9)14-8-11-12-5-6-15(11)2/h3-7H,8H2,1-2H3,(H,13,14)
InChIKeyANBKVLDSIPOPFQ-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.74
Rot. Bonds3

About 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine

5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine (PubChem CID 63295615) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
PubChem CID63295615
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
SMILESCc1ccc(NCc2nccn2C)nc1
InChIInChI=1S/C11H14N4/c1-9-3-4-10(13-7-9)14-8-11-12-5-6-15(11)2/h3-7H,8H2,1-2H3,(H,13,14)
InChIKeyANBKVLDSIPOPFQ-UHFFFAOYSA-N
XLogP1.74
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine (CID 63295615) is 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine is Cc1ccc(NCc2nccn2C)nc1.
What is the InChIKey of 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine?
The InChIKey is ANBKVLDSIPOPFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-9-3-4-10(13-7-9)14-8-11-12-5-6-15(11)2/h3-7H,8H2,1-2H3,(H,13,14).
What are the key properties of 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine?
5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine has a molecular weight of 202.26 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 63295615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).