4-(1-methylimidazol-4-yl)pyridin-2-amine

C9H10N4 — CID 130509091

IUPAC4-(1-methylimidazol-4-yl)pyridin-2-amine
SMILESCn1cnc(-c2ccnc(N)c2)c1
InChIInChI=1S/C9H10N4/c1-13-5-8(12-6-13)7-2-3-11-9(10)4-7/h2-6H,1H3,(H2,10,11)
InChIKeyMRPAGGGBVQUGII-UHFFFAOYSA-N
MW174.21 g/mol
LogP1.06
Rot. Bonds1

About 4-(1-methylimidazol-4-yl)pyridin-2-amine

4-(1-methylimidazol-4-yl)pyridin-2-amine (PubChem CID 130509091) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 4-(1-methylimidazol-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-(1-methylimidazol-4-yl)pyridin-2-amine
PubChem CID130509091
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name4-(1-methylimidazol-4-yl)pyridin-2-amine
SMILESCn1cnc(-c2ccnc(N)c2)c1
InChIInChI=1S/C9H10N4/c1-13-5-8(12-6-13)7-2-3-11-9(10)4-7/h2-6H,1H3,(H2,10,11)
InChIKeyMRPAGGGBVQUGII-UHFFFAOYSA-N
XLogP1.06
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylimidazol-4-yl)pyridin-2-amine?
The IUPAC name of 4-(1-methylimidazol-4-yl)pyridin-2-amine (CID 130509091) is 4-(1-methylimidazol-4-yl)pyridin-2-amine.
What is the SMILES notation for 4-(1-methylimidazol-4-yl)pyridin-2-amine?
The canonical SMILES for 4-(1-methylimidazol-4-yl)pyridin-2-amine is Cn1cnc(-c2ccnc(N)c2)c1.
What is the InChIKey of 4-(1-methylimidazol-4-yl)pyridin-2-amine?
The InChIKey is MRPAGGGBVQUGII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-13-5-8(12-6-13)7-2-3-11-9(10)4-7/h2-6H,1H3,(H2,10,11).
What are the key properties of 4-(1-methylimidazol-4-yl)pyridin-2-amine?
4-(1-methylimidazol-4-yl)pyridin-2-amine has a molecular weight of 174.21 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylimidazol-4-yl)pyridin-2-amine is sourced from PubChem (CID 130509091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).