N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide

C15H21N3O2 — CID 106251304

IUPACN-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide
SMILESCCC(CC)(CO)CNC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C15H21N3O2/c1-3-15(4-2,10-19)9-16-14(20)11-5-6-12-8-17-18-13(12)7-11/h5-8,19H,3-4,9-10H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyOJVJLLIFULDZQL-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.09
Rot. Bonds6

About N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide

N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide (PubChem CID 106251304) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide
PubChem CID106251304
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide
SMILESCCC(CC)(CO)CNC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C15H21N3O2/c1-3-15(4-2,10-19)9-16-14(20)11-5-6-12-8-17-18-13(12)7-11/h5-8,19H,3-4,9-10H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyOJVJLLIFULDZQL-UHFFFAOYSA-N
XLogP2.09
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(hydroxymethyl)pentan-3-yl]-1H-indazole-6-carboxamide
CID 62518655
N-[2-ethyl-2-(hydroxymethyl)butyl]naphthalene-2-carboxamide
CID 103843738
N-(2-methoxy-2-methylpropyl)-1H-indazole-6-carboxamide
CID 115665391
N-(2-methyl-2-methylsulfanylpropyl)-1H-indazole-6-carboxamide
CID 113246168
N-(1-hydroxy-3-methylpentan-3-yl)-1H-indazole-6-carboxamide
CID 106166733
N-(3-aminobutyl)-1H-indazole-6-carboxamide
CID 63253437
N-(3,3,3-trifluoropropyl)-1H-indazole-6-carboxamide
CID 63227826
N-(4,4,4-trifluorobutyl)-1H-indazole-6-carboxamide
CID 79039225
N-[(1-ethylcyclobutyl)methyl]-1H-indazole-6-carboxamide
CID 103741467
N-[2-ethyl-2-(hydroxymethyl)butyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 103843692
N-[2-ethyl-2-(hydroxymethyl)butyl]-1,3-dihydro-2-benzofuran-5-carboxamide
CID 103843199
N-(1-amino-2-methylpropan-2-yl)-1H-indazole-6-carboxamide
CID 63194069

Frequently Asked Questions

What is the IUPAC name of N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide?
The IUPAC name of N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide (CID 106251304) is N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide.
What is the SMILES notation for N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide?
The canonical SMILES for N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide is CCC(CC)(CO)CNC(=O)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide?
The InChIKey is OJVJLLIFULDZQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-3-15(4-2,10-19)9-16-14(20)11-5-6-12-8-17-18-13(12)7-11/h5-8,19H,3-4,9-10H2,1-2H3,(H,16,20)(H,17,18).
What are the key properties of N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide?
N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 2.09, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-indazole-6-carboxamide is sourced from PubChem (CID 106251304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).