6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide

C13H10ClN3O2 — CID 113206502

IUPAC6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide
SMILESCc1cc(NC(=O)c2c[nH]c3cc(Cl)ccc23)no1
InChIInChI=1S/C13H10ClN3O2/c1-7-4-12(17-19-7)16-13(18)10-6-15-11-5-8(14)2-3-9(10)11/h2-6,15H,1H3,(H,16,17,18)
InChIKeyLNRXFNXZUJXKGH-UHFFFAOYSA-N
MW275.70 g/mol
LogP3.37
Rot. Bonds2

About 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide

6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide (PubChem CID 113206502) has the molecular formula C13H10ClN3O2 and a molecular weight of 275.70 g/mol. Its IUPAC name is 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide
PubChem CID113206502
Molecular FormulaC13H10ClN3O2
Molecular Weight275.70 g/mol
Exact Mass275.05
IUPAC Name6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide
SMILESCc1cc(NC(=O)c2c[nH]c3cc(Cl)ccc23)no1
InChIInChI=1S/C13H10ClN3O2/c1-7-4-12(17-19-7)16-13(18)10-6-15-11-5-8(14)2-3-9(10)11/h2-6,15H,1H3,(H,16,17,18)
InChIKeyLNRXFNXZUJXKGH-UHFFFAOYSA-N
XLogP3.37
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.70
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-methylphenyl)-6-chloro-1H-indole-3-carboxamide
CID 113206476
6-chloro-N-[4-(dimethylamino)phenyl]-1H-indole-3-carboxamide
CID 113206465
6-chloro-N-(4-ethoxyphenyl)-1H-indole-3-carboxamide
CID 113206447
N-butan-2-yl-6-chloro-1H-indole-3-carboxamide
CID 113206344
6-chloro-N-(2,3,4-trifluorophenyl)-1H-indole-3-carboxamide
CID 113206499
ethyl 2-[(6-chloro-1H-indole-3-carbonyl)amino]propanoate
CID 75976916
2-chloro-5-hydroxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 106501199
2-fluoro-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 62509692
N-(4-chlorophenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206260
6-chloro-1H-indole-3-carboxamide
CID 130666489
CID 170645729
CID 170645729
3-chloro-4-fluoro-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 110764772

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide?
The IUPAC name of 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide (CID 113206502) is 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide?
The canonical SMILES for 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide is Cc1cc(NC(=O)c2c[nH]c3cc(Cl)ccc23)no1.
What is the InChIKey of 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide?
The InChIKey is LNRXFNXZUJXKGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3O2/c1-7-4-12(17-19-7)16-13(18)10-6-15-11-5-8(14)2-3-9(10)11/h2-6,15H,1H3,(H,16,17,18).
What are the key properties of 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide?
6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide has a molecular weight of 275.70 g/mol, XLogP of 3.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113206502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).