2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide

C18H17N3O2 — CID 144811408

IUPAC2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide
SMILESCC(C)n1cc2cc(-c3ccc(C(=O)C(N)=O)cc3)ccc2n1
InChIInChI=1S/C18H17N3O2/c1-11(2)21-10-15-9-14(7-8-16(15)20-21)12-3-5-13(6-4-12)17(22)18(19)23/h3-11H,1-2H3,(H2,19,23)
InChIKeyOJHDKOVFCVQTNS-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.95
Rot. Bonds4

About 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide

2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide (PubChem CID 144811408) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide
PubChem CID144811408
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide
SMILESCC(C)n1cc2cc(-c3ccc(C(=O)C(N)=O)cc3)ccc2n1
InChIInChI=1S/C18H17N3O2/c1-11(2)21-10-15-9-14(7-8-16(15)20-21)12-3-5-13(6-4-12)17(22)18(19)23/h3-11H,1-2H3,(H2,19,23)
InChIKeyOJHDKOVFCVQTNS-UHFFFAOYSA-N
XLogP2.95
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide 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

4-[1-[5-(4-tert-butylphenyl)indazol-2-yl]ethyl]benzamide
CID 175244935
1-[3-(3-chloro-4-cyclopropyloxyphenyl)propyl]pyrrolidine;ethane;2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide
CID 144811407
2-propan-2-ylindazol-5-ol
CID 84717775
(2-propan-2-ylindazol-5-yl)methanol
CID 90356269
2-oxo-2-[4-(4-propan-2-ylphenyl)phenyl]acetamide
CID 144811591
2-propan-2-ylindazole-5-carbonitrile
CID 84718934
2-(2-propan-2-ylindazol-5-yl)ethanamine
CID 84721669
2-[(2R,5S)-5-methyl-2-(2-propan-2-ylindazol-5-yl)piperidin-1-yl]-2-oxoacetamide
CID 169114595
ethyl 3-[3-methyl-4-[5-(2-propan-2-ylindazol-5-yl)-1,2,4-oxadiazol-3-yl]phenyl]propanoate
CID 90355971
6-(1-propan-2-ylpyrazol-4-yl)naphthalene-2-carboxylic acid
CID 172868751
2-nonan-3-ylindazole-5-carboxamide
CID 175937142
ethane;2-methylpropane;2-propan-2-ylindazole
CID 159582971

Frequently Asked Questions

What is the IUPAC name of 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide?
The IUPAC name of 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide (CID 144811408) is 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide.
What is the SMILES notation for 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide?
The canonical SMILES for 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide is CC(C)n1cc2cc(-c3ccc(C(=O)C(N)=O)cc3)ccc2n1.
What is the InChIKey of 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide?
The InChIKey is OJHDKOVFCVQTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-11(2)21-10-15-9-14(7-8-16(15)20-21)12-3-5-13(6-4-12)17(22)18(19)23/h3-11H,1-2H3,(H2,19,23).
What are the key properties of 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide?
2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide has a molecular weight of 307.35 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 144811408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).