N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide

C14H13N3OS — CID 110473029

IUPACN-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCc1nc(CC(=O)Nc2cccc3[nH]ccc23)cs1
InChIInChI=1S/C14H13N3OS/c1-9-16-10(8-19-9)7-14(18)17-13-4-2-3-12-11(13)5-6-15-12/h2-6,8,15H,7H2,1H3,(H,17,18)
InChIKeyURMHZMKCUJXZQT-UHFFFAOYSA-N
MW271.35 g/mol
LogP3.11
Rot. Bonds3

About N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide

N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide (PubChem CID 110473029) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
PubChem CID110473029
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC NameN-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCc1nc(CC(=O)Nc2cccc3[nH]ccc23)cs1
InChIInChI=1S/C14H13N3OS/c1-9-16-10(8-19-9)7-14(18)17-13-4-2-3-12-11(13)5-6-15-12/h2-6,8,15H,7H2,1H3,(H,17,18)
InChIKeyURMHZMKCUJXZQT-UHFFFAOYSA-N
XLogP3.11
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 9123420
N-(2-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 29453114
N-(3-chloro-2-fluorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 31507606
2-(2-methyl-1,3-thiazol-4-yl)-N-(2-phenylphenyl)acetamide
CID 29454554
2-fluoro-6-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]benzoic acid
CID 43442748
N-(2,6-difluorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110463255
N-(2-hydroxyphenyl)-2-(1H-indol-4-yl)acetamide
CID 139642119
N-(3-chloro-2-pyrazol-1-ylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 87007040
N-[3-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]phenyl]butanamide
CID 87026123
2-methyl-4-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]-1H-pyrrole-3-carboxylic acid
CID 82880336
6-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]pyridine-2-carboxylic acid
CID 63642384
4-(1H-indol-4-yloxymethyl)-2-methyl-1,3-thiazole
CID 141124782

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide (CID 110473029) is N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide is Cc1nc(CC(=O)Nc2cccc3[nH]ccc23)cs1.
What is the InChIKey of N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is URMHZMKCUJXZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c1-9-16-10(8-19-9)7-14(18)17-13-4-2-3-12-11(13)5-6-15-12/h2-6,8,15H,7H2,1H3,(H,17,18).
What are the key properties of N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 271.35 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 110473029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).