2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide

C18H14ClN5O2 — CID 69233196

IUPAC2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide
SMILESNc1n[nH]c2cc(-c3nc(C(=O)NCc4cccc(Cl)c4)co3)ccc12
InChIInChI=1S/C18H14ClN5O2/c19-12-3-1-2-10(6-12)8-21-17(25)15-9-26-18(22-15)11-4-5-13-14(7-11)23-24-16(13)20/h1-7,9H,8H2,(H,21,25)(H3,20,23,24)
InChIKeyYPCCZXKNRFUTDD-UHFFFAOYSA-N
MW367.80 g/mol
LogP3.38
Rot. Bonds4

About 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide

2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 69233196) has the molecular formula C18H14ClN5O2 and a molecular weight of 367.80 g/mol. Its IUPAC name is 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID69233196
Molecular FormulaC18H14ClN5O2
Molecular Weight367.80 g/mol
Exact Mass367.08
IUPAC Name2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide
SMILESNc1n[nH]c2cc(-c3nc(C(=O)NCc4cccc(Cl)c4)co3)ccc12
InChIInChI=1S/C18H14ClN5O2/c19-12-3-1-2-10(6-12)8-21-17(25)15-9-26-18(22-15)11-4-5-13-14(7-11)23-24-16(13)20/h1-7,9H,8H2,(H,21,25)(H3,20,23,24)
InChIKeyYPCCZXKNRFUTDD-UHFFFAOYSA-N
XLogP3.38
TPSA109.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.80
LogP ≤ 53.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-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

(3-amino-1H-indazol-6-yl) N-[(3-chlorophenyl)methyl]carbamate
CID 68886644
2-(3-aminophenyl)-N-[(3,4-difluorophenyl)methyl]-1,3-oxazole-4-carboxamide
CID 3494554
3-(3-amino-1H-indazol-5-yl)-N-[(3-chlorophenyl)methyl]propanamide
CID 58985468
2-(1-amino-2-methylbutyl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide
CID 3868304
N-[(3-chlorophenyl)methyl]-4-(5-naphthalen-1-yl-1H-pyrazol-3-yl)benzamide
CID 46091822
4-chloro-N-[(3-chlorophenyl)methyl]pyridine-2-carboxamide
CID 9401789
4-chloro-N-[(3-chlorophenyl)methyl]-1H-indazole-6-carboxamide
CID 59292119
N-[(3-chlorophenyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 55554809
2-(3-amino-1H-indazol-5-yl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]-1,3-oxazole-4-carboxamide
CID 11625034
6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine
CID 126696122
N-[(3-chlorophenyl)methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 17402682
2-phenyl-N-(pyridin-3-ylmethyl)-1,3-oxazole-4-carboxamide
CID 166211099

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide (CID 69233196) is 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide is Nc1n[nH]c2cc(-c3nc(C(=O)NCc4cccc(Cl)c4)co3)ccc12.
What is the InChIKey of 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is YPCCZXKNRFUTDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN5O2/c19-12-3-1-2-10(6-12)8-21-17(25)15-9-26-18(22-15)11-4-5-13-14(7-11)23-24-16(13)20/h1-7,9H,8H2,(H,21,25)(H3,20,23,24).
What are the key properties of 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide?
2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 367.80 g/mol, XLogP of 3.38, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-1H-indazol-6-yl)-N-[(3-chlorophenyl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 69233196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).