3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine

C14H16N6 — CID 114720067

IUPAC3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
SMILESCC(C)n1cc(-n2cncc2-c2cccnc2N)cn1
InChIInChI=1S/C14H16N6/c1-10(2)20-8-11(6-18-20)19-9-16-7-13(19)12-4-3-5-17-14(12)15/h3-10H,1-2H3,(H2,15,17)
InChIKeyRQAZGMIEPQPWFW-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.29
Rot. Bonds3

About 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine

3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine (PubChem CID 114720067) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
PubChem CID114720067
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
SMILESCC(C)n1cc(-n2cncc2-c2cccnc2N)cn1
InChIInChI=1S/C14H16N6/c1-10(2)20-8-11(6-18-20)19-9-16-7-13(19)12-4-3-5-17-14(12)15/h3-10H,1-2H3,(H2,15,17)
InChIKeyRQAZGMIEPQPWFW-UHFFFAOYSA-N
XLogP2.29
TPSA74.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
CID 114720076
3-[3-(1H-pyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
CID 114717949
3-[3-(4-propylphenyl)imidazol-4-yl]pyridin-2-amine
CID 114716022
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-methyl-3-pyridinyl)imidazol-4-yl]pyridin-2-amine
CID 114720343
3-(3-butan-2-ylimidazol-4-yl)pyridin-2-amine
CID 114717187
3-[3-(2-piperidin-1-ylpropyl)imidazol-4-yl]pyridin-2-amine
CID 114719316
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
3-[3-(2-phenylpropyl)imidazol-4-yl]pyridin-2-amine
CID 114722289
3-[3-(5-methylhexyl)imidazol-4-yl]pyridin-2-amine
CID 114721527

Frequently Asked Questions

What is the IUPAC name of 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine (CID 114720067) is 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine is CC(C)n1cc(-n2cncc2-c2cccnc2N)cn1.
What is the InChIKey of 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
The InChIKey is RQAZGMIEPQPWFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-10(2)20-8-11(6-18-20)19-9-16-7-13(19)12-4-3-5-17-14(12)15/h3-10H,1-2H3,(H2,15,17).
What are the key properties of 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine?
3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine has a molecular weight of 268.32 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 114720067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).