3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine

C14H15N5 — CID 141285157

IUPAC3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine
SMILESCC(C)c1[nH]ncc1-n1cnc(-c2cccnc2)c1
InChIInChI=1S/C14H15N5/c1-10(2)14-13(7-17-18-14)19-8-12(16-9-19)11-4-3-5-15-6-11/h3-10H,1-2H3,(H,17,18)
InChIKeyQMNXTWPGALKODJ-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.78
Rot. Bonds3

About 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine

3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine (PubChem CID 141285157) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine.

Molecular Properties

Compound Name3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine
PubChem CID141285157
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine
SMILESCC(C)c1[nH]ncc1-n1cnc(-c2cccnc2)c1
InChIInChI=1S/C14H15N5/c1-10(2)14-13(7-17-18-14)19-8-12(16-9-19)11-4-3-5-15-6-11/h3-10H,1-2H3,(H,17,18)
InChIKeyQMNXTWPGALKODJ-UHFFFAOYSA-N
XLogP2.78
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-(3-nitrophenyl)imidazol-4-yl]pyridine
CID 174550966
3-[1-(2,2-dimethoxyethyl)imidazol-4-yl]pyridine
CID 44604866
3-methoxy-4-[3-propan-2-yl-4-(4-pyridin-3-ylimidazol-1-yl)pyrazolo[3,4-b]pyridin-1-yl]benzamide
CID 67501043
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine
CID 86676680
3-(1-butylimidazol-4-yl)pyridine
CID 58668046
3-[1-(2-chloroethyl)imidazol-4-yl]pyridine
CID 22715654
3-(1-tritylimidazol-4-yl)pyridine
CID 90733826
2-(tert-butylamino)-4-[3-propan-2-yl-4-(4-pyridin-3-ylimidazol-1-yl)pyrazolo[3,4-b]pyridin-1-yl]benzamide
CID 67500777
N-(5-pyridin-3-yl-1H-pyrazol-3-yl)acetamide
CID 137321038
1,4-dimethyl-3-(4-pyridin-3-ylimidazol-1-yl)cyclohexa-2,4-diene-1-carboxylic acid
CID 71012593
methyl 2-(4-pyridin-3-ylimidazol-1-yl)acetate
CID 86591825

Frequently Asked Questions

What is the IUPAC name of 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine?
The IUPAC name of 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine (CID 141285157) is 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine.
What is the SMILES notation for 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine?
The canonical SMILES for 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine is CC(C)c1[nH]ncc1-n1cnc(-c2cccnc2)c1.
What is the InChIKey of 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine?
The InChIKey is QMNXTWPGALKODJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-10(2)14-13(7-17-18-14)19-8-12(16-9-19)11-4-3-5-15-6-11/h3-10H,1-2H3,(H,17,18).
What are the key properties of 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine?
3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine has a molecular weight of 253.31 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(5-propan-2-yl-1H-pyrazol-4-yl)imidazol-4-yl]pyridine is sourced from PubChem (CID 141285157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).