3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide

C14H11Cl2N3O3 — CID 60512470

IUPAC3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Cl)c(Cl)c1)Nc1c[nH]ccc1=O
InChIInChI=1S/C14H11Cl2N3O3/c15-9-2-1-8(5-10(9)16)14(22)18-7-13(21)19-11-6-17-4-3-12(11)20/h1-6H,7H2,(H,17,20)(H,18,22)(H,19,21)
InChIKeyFVWVORIYAAHOHY-UHFFFAOYSA-N
MW340.17 g/mol
LogP2.05
Rot. Bonds4

About 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide

3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide (PubChem CID 60512470) has the molecular formula C14H11Cl2N3O3 and a molecular weight of 340.17 g/mol. Its IUPAC name is 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide
PubChem CID60512470
Molecular FormulaC14H11Cl2N3O3
Molecular Weight340.17 g/mol
Exact Mass339.02
IUPAC Name3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Cl)c(Cl)c1)Nc1c[nH]ccc1=O
InChIInChI=1S/C14H11Cl2N3O3/c15-9-2-1-8(5-10(9)16)14(22)18-7-13(21)19-11-6-17-4-3-12(11)20/h1-6H,7H2,(H,17,20)(H,18,22)(H,19,21)
InChIKeyFVWVORIYAAHOHY-UHFFFAOYSA-N
XLogP2.05
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.17
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dichloro-N-[2-(2,6-dichloroanilino)-2-oxoethyl]benzamide
CID 113001415
5-methyl-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]thiophene-2-carboxamide
CID 60512469
2-chloro-N-(4-oxo-1H-pyridin-3-yl)acetamide
CID 46737876
N-[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]-3,4-dichlorobenzamide
CID 9295430
3,4-dichloro-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]benzamide
CID 26592239
N-[2-(3,4-dichloroanilino)-2-oxoethyl]-3,4-dimethylbenzamide
CID 9411502
3,4-dichloro-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide
CID 112997392
N-[2-(benzylamino)-2-oxoethyl]-3,4-dichlorobenzamide
CID 9336870
3,4-dichloro-N-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]benzamide
CID 42467160
ethyl 2-[(3,4-dichlorobenzoyl)amino]acetate
CID 5039478
N-[2-(3-aminopropylamino)-2-oxoethyl]-3,4-dichlorobenzamide;hydrochloride
CID 119405889
3,4-dichloro-N-[2-(3-methylbutylamino)-2-oxoethyl]benzamide
CID 27556673

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide?
The IUPAC name of 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide (CID 60512470) is 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide.
What is the SMILES notation for 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide?
The canonical SMILES for 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide is O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)Nc1c[nH]ccc1=O.
What is the InChIKey of 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide?
The InChIKey is FVWVORIYAAHOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3O3/c15-9-2-1-8(5-10(9)16)14(22)18-7-13(21)19-11-6-17-4-3-12(11)20/h1-6H,7H2,(H,17,20)(H,18,22)(H,19,21).
What are the key properties of 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide?
3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide has a molecular weight of 340.17 g/mol, XLogP of 2.05, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-[2-oxo-2-[(4-oxo-1H-pyridin-3-yl)amino]ethyl]benzamide is sourced from PubChem (CID 60512470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).