6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol

C17H18N4O — CID 67251409

IUPAC6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol
SMILESCc1nc(Cn2nc(C3CC3)c3c(N)cccc32)ccc1O
InChIInChI=1S/C17H18N4O/c1-10-15(22)8-7-12(19-10)9-21-14-4-2-3-13(18)16(14)17(20-21)11-5-6-11/h2-4,7-8,11,22H,5-6,9,18H2,1H3
InChIKeyPUCKJOMJLNZIBL-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.95
Rot. Bonds3

About 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol

6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol (PubChem CID 67251409) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol.

Molecular Properties

Compound Name6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol
PubChem CID67251409
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC Name6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol
SMILESCc1nc(Cn2nc(C3CC3)c3c(N)cccc32)ccc1O
InChIInChI=1S/C17H18N4O/c1-10-15(22)8-7-12(19-10)9-21-14-4-2-3-13(18)16(14)17(20-21)11-5-6-11/h2-4,7-8,11,22H,5-6,9,18H2,1H3
InChIKeyPUCKJOMJLNZIBL-UHFFFAOYSA-N
XLogP2.95
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol?
The IUPAC name of 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol (CID 67251409) is 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol.
What is the SMILES notation for 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol?
The canonical SMILES for 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol is Cc1nc(Cn2nc(C3CC3)c3c(N)cccc32)ccc1O.
What is the InChIKey of 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol?
The InChIKey is PUCKJOMJLNZIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c1-10-15(22)8-7-12(19-10)9-21-14-4-2-3-13(18)16(14)17(20-21)11-5-6-11/h2-4,7-8,11,22H,5-6,9,18H2,1H3.
What are the key properties of 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol?
6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol has a molecular weight of 294.36 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-amino-3-cyclopropylindazol-1-yl)methyl]-2-methylpyridin-3-ol is sourced from PubChem (CID 67251409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).