N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide

C13H17N3O2 — CID 109388543

IUPACN-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)N(C)C(C)CO)c2c1
InChIInChI=1S/C13H17N3O2/c1-8-4-5-11-10(6-8)12(15-14-11)13(18)16(3)9(2)7-17/h4-6,9,17H,7H2,1-3H3,(H,14,15)
InChIKeyZOJYUGJIWFNKPI-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.32
Rot. Bonds3

About N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide

N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide (PubChem CID 109388543) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide
PubChem CID109388543
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC NameN-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)N(C)C(C)CO)c2c1
InChIInChI=1S/C13H17N3O2/c1-8-4-5-11-10(6-8)12(15-14-11)13(18)16(3)9(2)7-17/h4-6,9,17H,7H2,1-3H3,(H,14,15)
InChIKeyZOJYUGJIWFNKPI-UHFFFAOYSA-N
XLogP1.32
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-N,5-dimethyl-1H-indazole-3-carboxamide
CID 78865955
N-(1-hydroxypropan-2-yl)-5-methyl-1H-indazole-3-carboxamide
CID 110888660
N-ethyl-5-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1H-indazole-3-carboxamide
CID 78867674
N-[2-[di(propan-2-yl)amino]ethyl]-5-methyl-1H-indazole-3-carboxamide
CID 78859037
N-[[4-(dimethylamino)phenyl]methyl]-N,5-dimethyl-1H-indazole-3-carboxamide
CID 78867975
N-ethyl-N-[(4-methoxyphenyl)methyl]-5-methyl-1H-indazole-3-carboxamide
CID 78866013
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,5-dimethyl-1H-indazole-3-carboxamide
CID 56703447
5-methyl-N-prop-2-enyl-1H-indazole-3-carboxamide
CID 78859111
5-amino-N-methyl-N-(1-methylsulfanylbutan-2-yl)-1H-indazole-3-carboxamide
CID 115985170
N,5-dimethyl-N-(1-oxothian-4-yl)-1H-indazole-3-carboxamide
CID 75535689
N-(cyclopropylmethyl)-5-methyl-1H-indazole-3-carboxamide
CID 78869607
N-cyclopropyl-5-methyl-N-(pyridin-4-ylmethyl)-1H-indazole-3-carboxamide
CID 86852999

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide (CID 109388543) is N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide is Cc1ccc2[nH]nc(C(=O)N(C)C(C)CO)c2c1.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide?
The InChIKey is ZOJYUGJIWFNKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-8-4-5-11-10(6-8)12(15-14-11)13(18)16(3)9(2)7-17/h4-6,9,17H,7H2,1-3H3,(H,14,15).
What are the key properties of N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide?
N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide has a molecular weight of 247.30 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-N,5-dimethyl-1H-indazole-3-carboxamide is sourced from PubChem (CID 109388543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).