2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide

C17H14Cl2N6O2 — CID 55674423

IUPAC2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cc(NC(=O)c2cc(Cl)ccc2-n2cnnn2)ccc1Cl
InChIInChI=1S/C17H14Cl2N6O2/c1-24(2)17(27)12-8-11(4-5-14(12)19)21-16(26)13-7-10(18)3-6-15(13)25-9-20-22-23-25/h3-9H,1-2H3,(H,21,26)
InChIKeyOLZNMCJAQKRENO-UHFFFAOYSA-N
MW405.25 g/mol
LogP2.92
Rot. Bonds4

About 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide

2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide (PubChem CID 55674423) has the molecular formula C17H14Cl2N6O2 and a molecular weight of 405.25 g/mol. Its IUPAC name is 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide
PubChem CID55674423
Molecular FormulaC17H14Cl2N6O2
Molecular Weight405.25 g/mol
Exact Mass404.06
IUPAC Name2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cc(NC(=O)c2cc(Cl)ccc2-n2cnnn2)ccc1Cl
InChIInChI=1S/C17H14Cl2N6O2/c1-24(2)17(27)12-8-11(4-5-14(12)19)21-16(26)13-7-10(18)3-6-15(13)25-9-20-22-23-25/h3-9H,1-2H3,(H,21,26)
InChIKeyOLZNMCJAQKRENO-UHFFFAOYSA-N
XLogP2.92
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.25
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-N-(1-methylpyrazol-4-yl)-2-(tetrazol-1-yl)benzamide
CID 32609786
N-(4-bromophenyl)-4-chloro-2-(tetrazol-1-yl)benzamide
CID 42571314
4-chloro-N-phenyl-2-(tetrazol-1-yl)benzamide
CID 42571537
2-chloro-N,N-diethyl-4-[[2-(tetrazol-1-yl)benzoyl]amino]benzamide
CID 55673413
5-bromo-N-(2,4-dichlorophenyl)-2-(tetrazol-1-yl)benzamide
CID 42571607
5-chloro-N-(4-chlorophenyl)-2-methoxy-4-(tetrazol-1-yl)benzamide
CID 87000459
ethyl 4-[[4-chloro-2-(tetrazol-1-yl)benzoyl]amino]benzoate
CID 42582252
N-(2,5-dichlorophenyl)-4-fluoro-2-(tetrazol-1-yl)benzamide
CID 29129325
5-chloro-N-[(1-methylbenzimidazol-2-yl)methyl]-2-(tetrazol-1-yl)benzamide
CID 55668878
(2S)-2-[[2-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]acetyl]amino]-4-methylpentanoic acid
CID 120694899
5-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(tetrazol-1-yl)benzamide
CID 39918772
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-methyl-4-(tetrazol-1-yl)benzamide
CID 55616979

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide?
The IUPAC name of 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide (CID 55674423) is 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide?
The canonical SMILES for 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide is CN(C)C(=O)c1cc(NC(=O)c2cc(Cl)ccc2-n2cnnn2)ccc1Cl.
What is the InChIKey of 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide?
The InChIKey is OLZNMCJAQKRENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N6O2/c1-24(2)17(27)12-8-11(4-5-14(12)19)21-16(26)13-7-10(18)3-6-15(13)25-9-20-22-23-25/h3-9H,1-2H3,(H,21,26).
What are the key properties of 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide?
2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide has a molecular weight of 405.25 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[[5-chloro-2-(tetrazol-1-yl)benzoyl]amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 55674423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).