3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide

C11H13Cl2NO2 — CID 30481549

IUPAC3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide
SMILESCOC[C@@H](C)NC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H13Cl2NO2/c1-7(6-16-2)14-11(15)8-3-9(12)5-10(13)4-8/h3-5,7H,6H2,1-2H3,(H,14,15)/t7-/m1/s1
InChIKeyAZCYJFHCONZFDY-SSDOTTSWSA-N
MW262.14 g/mol
LogP2.76
Rot. Bonds4

About 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide

3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide (PubChem CID 30481549) has the molecular formula C11H13Cl2NO2 and a molecular weight of 262.14 g/mol. Its IUPAC name is 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide
PubChem CID30481549
Molecular FormulaC11H13Cl2NO2
Molecular Weight262.14 g/mol
Exact Mass261.03
IUPAC Name3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide
SMILESCOC[C@@H](C)NC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H13Cl2NO2/c1-7(6-16-2)14-11(15)8-3-9(12)5-10(13)4-8/h3-5,7H,6H2,1-2H3,(H,14,15)/t7-/m1/s1
InChIKeyAZCYJFHCONZFDY-SSDOTTSWSA-N
XLogP2.76
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-5-chloro-N-(1-methoxypropan-2-yl)benzamide
CID 103826410
3-chloro-5-(1-methoxypropan-2-ylcarbamoyl)benzenesulfonyl chloride
CID 65368353
4-amino-3,5-dichloro-N-(1-methoxypropan-2-yl)benzamide
CID 82787029
3,5-dichloro-N-(1-chloro-3-methoxypropan-2-yl)benzamide
CID 106183248
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide
CID 96525639
3,5-dichloro-N-(5-chloropentan-2-yl)benzamide
CID 114305934
4-amino-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
CID 55158856
methyl (2S,3S)-2-[(3,5-dichlorobenzoyl)amino]-3-hydroxybutanoate
CID 124571933
N-[(2R)-1-methoxypropan-2-yl]-3,4-dimethylbenzamide
CID 5390617
4-(ethylamino)-3,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
CID 63183722
7-chloro-N-[(2S)-1-methoxypropan-2-yl]-1,3-benzodioxole-5-carboxamide
CID 34834045

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide?
The IUPAC name of 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide (CID 30481549) is 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide.
What is the SMILES notation for 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide?
The canonical SMILES for 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide is COC[C@@H](C)NC(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide?
The InChIKey is AZCYJFHCONZFDY-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H13Cl2NO2/c1-7(6-16-2)14-11(15)8-3-9(12)5-10(13)4-8/h3-5,7H,6H2,1-2H3,(H,14,15)/t7-/m1/s1.
What are the key properties of 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide?
3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide has a molecular weight of 262.14 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide is sourced from PubChem (CID 30481549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).