5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole

C14H14N4 — CID 172763000

IUPAC5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole
SMILESCc1cn(-c2ccc3[nH]ncc3c2)c(C2CC2)n1
InChIInChI=1S/C14H14N4/c1-9-8-18(14(16-9)10-2-3-10)12-4-5-13-11(6-12)7-15-17-13/h4-8,10H,2-3H2,1H3,(H,15,17)
InChIKeyLYDBHRKMUOPDFF-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.93
Rot. Bonds2

About 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole

5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole (PubChem CID 172763000) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole.

Molecular Properties

Compound Name5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole
PubChem CID172763000
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole
SMILESCc1cn(-c2ccc3[nH]ncc3c2)c(C2CC2)n1
InChIInChI=1S/C14H14N4/c1-9-8-18(14(16-9)10-2-3-10)12-4-5-13-11(6-12)7-15-17-13/h4-8,10H,2-3H2,1H3,(H,15,17)
InChIKeyLYDBHRKMUOPDFF-UHFFFAOYSA-N
XLogP2.93
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[4-tert-butyl-2-(trifluoromethyl)imidazol-1-yl]-1H-indazole
CID 172744174
(1S,2R,6S,7R)-4-(1H-indazol-5-yl)-4-azatricyclo[5.2.2.02,6]undec-8-ene-3,5-dione
CID 68547482
ethane;5-methyl-1H-indazole
CID 178026047
2-(1H-indazol-5-yl)-6-methoxyisoindol-1-ol
CID 91063844
cyclooctyl-[1-(1H-indazol-5-yl)pyrrolo[2,3-b]pyridin-5-yl]methanone
CID 167015527
6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 69179636
3-(1H-indazol-5-yloxy)cyclopentan-1-ol
CID 22933692
5-[3-cyclopropyl-4-(trifluoromethyl)-2H-imidazol-1-yl]-1H-indazole
CID 172744342
5-pyrrolidin-3-yl-1H-indazole
CID 82405322
N-[6-methyl-2-(3-piperidin-4-ylindol-1-yl)pyrimidin-4-yl]-1H-indazol-5-amine
CID 155664047
potassium 1-cyclopropyl-8-(1H-indazol-5-yl)-7,9-dimethyl-4-oxoquinolizine-3-carboxylate
CID 88925649
5-(2-methyl-4-pyridinyl)-1H-indazole
CID 143158050

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole?
The IUPAC name of 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole (CID 172763000) is 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole.
What is the SMILES notation for 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole?
The canonical SMILES for 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole is Cc1cn(-c2ccc3[nH]ncc3c2)c(C2CC2)n1.
What is the InChIKey of 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole?
The InChIKey is LYDBHRKMUOPDFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-8-18(14(16-9)10-2-3-10)12-4-5-13-11(6-12)7-15-17-13/h4-8,10H,2-3H2,1H3,(H,15,17).
What are the key properties of 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole?
5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole has a molecular weight of 238.29 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopropyl-4-methylimidazol-1-yl)-1H-indazole is sourced from PubChem (CID 172763000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).