N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide

C20H19N5OS — CID 27668468

IUPACN-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCCCn1c(NC(=O)Cc2csc(-c3ccccn3)n2)nc2ccccc21
InChIInChI=1S/C20H19N5OS/c1-2-11-25-17-9-4-3-7-15(17)23-20(25)24-18(26)12-14-13-27-19(22-14)16-8-5-6-10-21-16/h3-10,13H,2,11-12H2,1H3,(H,23,24,26)
InChIKeyKVMJGLFFTKHXMQ-UHFFFAOYSA-N
MW377.47 g/mol
LogP4.15
Rot. Bonds6

About N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide

N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 27668468) has the molecular formula C20H19N5OS and a molecular weight of 377.47 g/mol. Its IUPAC name is N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
PubChem CID27668468
Molecular FormulaC20H19N5OS
Molecular Weight377.47 g/mol
Exact Mass377.13
IUPAC NameN-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCCCn1c(NC(=O)Cc2csc(-c3ccccn3)n2)nc2ccccc21
InChIInChI=1S/C20H19N5OS/c1-2-11-25-17-9-4-3-7-15(17)23-20(25)24-18(26)12-14-13-27-19(22-14)16-8-5-6-10-21-16/h3-10,13H,2,11-12H2,1H3,(H,23,24,26)
InChIKeyKVMJGLFFTKHXMQ-UHFFFAOYSA-N
XLogP4.15
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 17434682
N-propan-2-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 27648148
N-(3-acetylphenyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 34829771
(2S)-2-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]hexanoic acid
CID 39165215
N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 16563450
N-(1-propylbenzimidazol-2-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 27134350
N-[2-(ethylamino)ethyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide;dihydrochloride
CID 119506122
(2R)-3-methyl-2-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]butanoic acid
CID 39165191
4-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]benzamide
CID 26721108
N-(1-propylbenzimidazol-2-yl)nonanamide
CID 162645010
N-(1-hydroxy-3-methylpentan-3-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 110002106
N-[2-(2-ethylanilino)-2-oxoethyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 27768196

Frequently Asked Questions

What is the IUPAC name of N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide (CID 27668468) is N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide is CCCn1c(NC(=O)Cc2csc(-c3ccccn3)n2)nc2ccccc21.
What is the InChIKey of N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is KVMJGLFFTKHXMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5OS/c1-2-11-25-17-9-4-3-7-15(17)23-20(25)24-18(26)12-14-13-27-19(22-14)16-8-5-6-10-21-16/h3-10,13H,2,11-12H2,1H3,(H,23,24,26).
What are the key properties of N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 377.47 g/mol, XLogP of 4.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propylbenzimidazol-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 27668468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).