2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide

C16H15Cl2NOS — CID 71781417

IUPAC2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide
SMILESO=C(c1cc(Cl)ccc1Cl)N(CCc1cccs1)C1CC1
InChIInChI=1S/C16H15Cl2NOS/c17-11-3-6-15(18)14(10-11)16(20)19(12-4-5-12)8-7-13-2-1-9-21-13/h1-3,6,9-10,12H,4-5,7-8H2
InChIKeyARFIVMBRSCLRDJ-UHFFFAOYSA-N
MW340.27 g/mol
LogP4.90
Rot. Bonds5

About 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide

2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide (PubChem CID 71781417) has the molecular formula C16H15Cl2NOS and a molecular weight of 340.27 g/mol. Its IUPAC name is 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide
PubChem CID71781417
Molecular FormulaC16H15Cl2NOS
Molecular Weight340.27 g/mol
Exact Mass339.03
IUPAC Name2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide
SMILESO=C(c1cc(Cl)ccc1Cl)N(CCc1cccs1)C1CC1
InChIInChI=1S/C16H15Cl2NOS/c17-11-3-6-15(18)14(10-11)16(20)19(12-4-5-12)8-7-13-2-1-9-21-13/h1-3,6,9-10,12H,4-5,7-8H2
InChIKeyARFIVMBRSCLRDJ-UHFFFAOYSA-N
XLogP4.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.27
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide
CID 62242599
N-cyclopropyl-N-(2-thiophen-2-ylethyl)-2-(trifluoromethyl)benzamide
CID 90496054
3-(4-chlorophenyl)-1-(oxan-4-yl)-1-(2-thiophen-2-ylethyl)urea
CID 90611093
5-bromo-2-chloro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79036874
N-cyclopropyl-1-methyl-N-(2-thiophen-2-ylethyl)triazole-4-carboxamide
CID 72717917
2-chloro-N-cyclopropyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide
CID 37484213
5-chloro-2-(ethylamino)-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79489207
N-cyclopropyl-4-piperidin-1-ylsulfonyl-N-(2-thiophen-2-ylethyl)benzamide
CID 90496092
2-ethoxy-N-(oxan-4-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 90610971
2,5-dichloro-N'-(3-thiophen-2-ylpropanoyl)benzohydrazide
CID 27834779
N-cyclopropyl-2,5-dimethyl-N-(thiophen-2-ylmethyl)thiophene-3-carboxamide
CID 134004531
[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2,5-dichlorobenzoate
CID 7604407

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide (CID 71781417) is 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide is O=C(c1cc(Cl)ccc1Cl)N(CCc1cccs1)C1CC1.
What is the InChIKey of 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide?
The InChIKey is ARFIVMBRSCLRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NOS/c17-11-3-6-15(18)14(10-11)16(20)19(12-4-5-12)8-7-13-2-1-9-21-13/h1-3,6,9-10,12H,4-5,7-8H2.
What are the key properties of 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide?
2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide has a molecular weight of 340.27 g/mol, XLogP of 4.90, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 71781417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).