N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide

C15H13Cl2NO — CID 793526

IUPACN-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H13Cl2NO/c1-10(12-7-8-13(16)14(17)9-12)18-15(19)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)/t10-/m1/s1
InChIKeyREZWKOICQFKHOG-SNVBAGLBSA-N
MW294.18 g/mol
LogP4.48
Rot. Bonds3

About N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide

N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide (PubChem CID 793526) has the molecular formula C15H13Cl2NO and a molecular weight of 294.18 g/mol. Its IUPAC name is N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide.

Molecular Properties

Compound NameN-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide
PubChem CID793526
Molecular FormulaC15H13Cl2NO
Molecular Weight294.18 g/mol
Exact Mass293.04
IUPAC NameN-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H13Cl2NO/c1-10(12-7-8-13(16)14(17)9-12)18-15(19)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)/t10-/m1/s1
InChIKeyREZWKOICQFKHOG-SNVBAGLBSA-N
XLogP4.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.18
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(chloromethyl)-N-[1-(3,4-dichlorophenyl)ethyl]benzamide
CID 43470617
3-cyano-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]benzamide
CID 35905657
3-bromo-5-chloro-N-[1-(3,4-dichlorophenyl)ethyl]benzamide
CID 107951762
4-amino-N-[1-(3,4-dichlorophenyl)ethyl]-3-methylbenzamide
CID 61249263
4-(acetamidomethyl)-N-[1-(3,4-dichlorophenyl)ethyl]benzamide
CID 78804735
phenyl N-[1-(3,4-dichlorophenyl)ethyl]carbamate
CID 60629562
[4-[4-[[(1R)-1-(3,4-dichlorophenyl)ethyl]carbamoyl]phenyl]phenyl] acetate
CID 2533185
N-[(1R)-1-(3,4-dichlorophenyl)ethyl]quinoline-2-carboxamide
CID 9467467
4-amino-N-[1-(3,4-dichlorophenyl)ethyl]-3-fluorobenzamide
CID 63188927
N-[1-(3-acetamidophenyl)ethyl]benzamide
CID 46468162
N-[(1S)-1-(4-aminophenyl)ethyl]benzamide
CID 35525579
2-(aminomethyl)-N-[1-(3,4-dichlorophenyl)ethyl]pyridine-4-carboxamide
CID 114326268

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide?
The IUPAC name of N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide (CID 793526) is N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide.
What is the SMILES notation for N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide?
The canonical SMILES for N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide is C[C@@H](NC(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide?
The InChIKey is REZWKOICQFKHOG-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H13Cl2NO/c1-10(12-7-8-13(16)14(17)9-12)18-15(19)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)/t10-/m1/s1.
What are the key properties of N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide?
N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide has a molecular weight of 294.18 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide is sourced from PubChem (CID 793526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).