2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide

C16H17N3OS — CID 7755575

IUPAC2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide
SMILESCc1nc2ccccc2n1CC(=O)N[C@H](C)c1cccs1
InChIInChI=1S/C16H17N3OS/c1-11(15-8-5-9-21-15)17-16(20)10-19-12(2)18-13-6-3-4-7-14(13)19/h3-9,11H,10H2,1-2H3,(H,17,20)/t11-/m1/s1
InChIKeySAMHSMYJLQIABL-LLVKDONJSA-N
MW299.40 g/mol
LogP3.28
Rot. Bonds4

About 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide

2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide (PubChem CID 7755575) has the molecular formula C16H17N3OS and a molecular weight of 299.40 g/mol. Its IUPAC name is 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide.

Molecular Properties

Compound Name2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide
PubChem CID7755575
Molecular FormulaC16H17N3OS
Molecular Weight299.40 g/mol
Exact Mass299.11
IUPAC Name2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide
SMILESCc1nc2ccccc2n1CC(=O)N[C@H](C)c1cccs1
InChIInChI=1S/C16H17N3OS/c1-11(15-8-5-9-21-15)17-16(20)10-19-12(2)18-13-6-3-4-7-14(13)19/h3-9,11H,10H2,1-2H3,(H,17,20)/t11-/m1/s1
InChIKeySAMHSMYJLQIABL-LLVKDONJSA-N
XLogP3.28
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R)-1-(4-ethylphenyl)ethyl]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755480
N-[1-[1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazol-2-yl]ethyl]propanamide
CID 17029919
N-(1-amino-4-methylpentan-2-yl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 119587115
2-(2-methylbenzimidazol-1-yl)-N-(1-thiophen-2-ylethylideneamino)acetamide
CID 781499
2-(2-methylbenzimidazol-1-yl)-N-[(1S)-1-(2-propyl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 125161067
2-(2-methylbenzimidazol-1-yl)-N-(2-methylpropylcarbamoyl)acetamide
CID 7755635
2-(1-tert-butyl-3-methyl-5-oxo-1,2,4-triazol-4-yl)-N-(1-thiophen-2-ylethyl)acetamide
CID 84597865
N-[(1R)-1-(1-ethylbenzimidazol-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 95234003
N-(2-amino-1-cyclopropylethyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 119615273
N-[furan-2-yl(phenyl)methyl]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 51202325
2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
CID 17032674
2-[2-(1-chloroethyl)benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 43667741

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide?
The IUPAC name of 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide (CID 7755575) is 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide.
What is the SMILES notation for 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide?
The canonical SMILES for 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide is Cc1nc2ccccc2n1CC(=O)N[C@H](C)c1cccs1.
What is the InChIKey of 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide?
The InChIKey is SAMHSMYJLQIABL-LLVKDONJSA-N. The full InChI is InChI=1S/C16H17N3OS/c1-11(15-8-5-9-21-15)17-16(20)10-19-12(2)18-13-6-3-4-7-14(13)19/h3-9,11H,10H2,1-2H3,(H,17,20)/t11-/m1/s1.
What are the key properties of 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide?
2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide has a molecular weight of 299.40 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylbenzimidazol-1-yl)-N-[(1R)-1-thiophen-2-ylethyl]acetamide is sourced from PubChem (CID 7755575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).