3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide

C14H14ClNOS — CID 2330910

IUPAC3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide
SMILESC[C@H](Cc1cccs1)NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C14H14ClNOS/c1-10(8-13-6-3-7-18-13)16-14(17)11-4-2-5-12(15)9-11/h2-7,9-10H,8H2,1H3,(H,16,17)/t10-/m1/s1
InChIKeyDFHDOCAKFAMCND-SNVBAGLBSA-N
MW279.79 g/mol
LogP3.76
Rot. Bonds4

About 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide

3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide (PubChem CID 2330910) has the molecular formula C14H14ClNOS and a molecular weight of 279.79 g/mol. Its IUPAC name is 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide
PubChem CID2330910
Molecular FormulaC14H14ClNOS
Molecular Weight279.79 g/mol
Exact Mass279.05
IUPAC Name3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide
SMILESC[C@H](Cc1cccs1)NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C14H14ClNOS/c1-10(8-13-6-3-7-18-13)16-14(17)11-4-2-5-12(15)9-11/h2-7,9-10H,8H2,1H3,(H,16,17)/t10-/m1/s1
InChIKeyDFHDOCAKFAMCND-SNVBAGLBSA-N
XLogP3.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.79
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dichloro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 18711929
3-iodo-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 60722842
methane;N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 159530206
3,4-dihydroxy-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 103956007
4-fluoro-3-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 63212844
2-[3-(1-thiophen-2-ylpropan-2-ylcarbamoyl)anilino]acetic acid
CID 46991021
4-(aminomethyl)-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 43705091
3-bromo-4-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 79467456
2-bromo-N-(1-thiophen-2-ylpropan-2-yl)pyridine-4-carboxamide
CID 103752713
N-(4-bromobutan-2-yl)-3-chlorobenzamide
CID 83179175
N-[(2S)-1-(3-chlorophenyl)propan-2-yl]-2-thiophen-2-ylacetamide
CID 51947501
2-amino-3-chloro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 115540690

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide?
The IUPAC name of 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide (CID 2330910) is 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide.
What is the SMILES notation for 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide?
The canonical SMILES for 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide is C[C@H](Cc1cccs1)NC(=O)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide?
The InChIKey is DFHDOCAKFAMCND-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H14ClNOS/c1-10(8-13-6-3-7-18-13)16-14(17)11-4-2-5-12(15)9-11/h2-7,9-10H,8H2,1H3,(H,16,17)/t10-/m1/s1.
What are the key properties of 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide?
3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide has a molecular weight of 279.79 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[(2R)-1-thiophen-2-ylpropan-2-yl]benzamide is sourced from PubChem (CID 2330910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).