3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine

C11H10N6 — CID 114717949

IUPAC3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
SMILESNc1ncccc1-c1cncn1-c1cn[nH]c1
InChIInChI=1S/C11H10N6/c12-11-9(2-1-3-14-11)10-6-13-7-17(10)8-4-15-16-5-8/h1-7H,(H2,12,14)(H,15,16)
InChIKeyJKVDEDMUVVNJLW-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.24
Rot. Bonds2

About 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine

3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine (PubChem CID 114717949) has the molecular formula C11H10N6 and a molecular weight of 226.24 g/mol. Its IUPAC name is 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
PubChem CID114717949
Molecular FormulaC11H10N6
Molecular Weight226.24 g/mol
Exact Mass226.10
IUPAC Name3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
SMILESNc1ncccc1-c1cncn1-c1cn[nH]c1
InChIInChI=1S/C11H10N6/c12-11-9(2-1-3-14-11)10-6-13-7-17(10)8-4-15-16-5-8/h1-7H,(H2,12,14)(H,15,16)
InChIKeyJKVDEDMUVVNJLW-UHFFFAOYSA-N
XLogP1.24
TPSA85.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(4-ethoxyphenyl)imidazol-4-yl]pyridin-2-amine
CID 114716275
3-[3-(3,4-difluorophenyl)imidazol-4-yl]pyridin-2-amine
CID 114717143
3-[3-(4-propylphenyl)imidazol-4-yl]pyridin-2-amine
CID 114716022
3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
CID 114720067
3-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]pyridin-2-amine
CID 114720343
3-(2-amino-3-pyridinyl)pyridin-2-amine
CID 1236677
3-(3-butan-2-ylimidazol-4-yl)pyridin-2-amine
CID 114717187
methyl 2-[5-(2-amino-3-pyridinyl)imidazol-1-yl]propanoate
CID 114718970
3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine
CID 114720988
1-(1H-pyrazol-4-yl)pyrrolo[3,2-b]pyridin-3-amine
CID 175885701
3-[3-(1-pyridin-3-ylethyl)imidazol-4-yl]pyridin-2-amine
CID 114717857
3-(3-but-3-en-2-ylimidazol-4-yl)pyridin-2-amine
CID 114722123

Frequently Asked Questions

What is the IUPAC name of 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine (CID 114717949) is 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine is Nc1ncccc1-c1cncn1-c1cn[nH]c1.
What is the InChIKey of 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
The InChIKey is JKVDEDMUVVNJLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6/c12-11-9(2-1-3-14-11)10-6-13-7-17(10)8-4-15-16-5-8/h1-7H,(H2,12,14)(H,15,16).
What are the key properties of 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine has a molecular weight of 226.24 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 114717949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).