N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide

C16H14Cl2N6O — CID 9195215

IUPACN-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1nnnn1-c1ccccc1
InChIInChI=1S/C16H14Cl2N6O/c1-23(10-15(25)19-11-7-8-13(17)14(18)9-11)16-20-21-22-24(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,25)
InChIKeyVEXAEIUCWWFXCH-UHFFFAOYSA-N
MW377.24 g/mol
LogP3.04
Rot. Bonds5

About N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide

N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide (PubChem CID 9195215) has the molecular formula C16H14Cl2N6O and a molecular weight of 377.24 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
PubChem CID9195215
Molecular FormulaC16H14Cl2N6O
Molecular Weight377.24 g/mol
Exact Mass376.06
IUPAC NameN-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1nnnn1-c1ccccc1
InChIInChI=1S/C16H14Cl2N6O/c1-23(10-15(25)19-11-7-8-13(17)14(18)9-11)16-20-21-22-24(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,25)
InChIKeyVEXAEIUCWWFXCH-UHFFFAOYSA-N
XLogP3.04
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.24
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
CID 4788437
2-[methyl-(1-phenyltetrazol-5-yl)amino]-N-propylacetamide
CID 9195767
2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 133339018
N-[2-(3,4-dichloroanilino)-2-oxoethyl]-N-methylbenzamide
CID 7718956
1-(3,4-dichlorophenyl)-3-[2-[(1-phenyltetrazol-5-yl)amino]ethyl]urea
CID 78896471
N-(3,4-dichlorophenyl)-2-(N-ethylanilino)acetamide
CID 54808800
3-[[2-(3,4-dichloroanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60704303
1-[methyl-(1-phenyltetrazol-5-yl)amino]propan-2-ol
CID 62333734
N-(3,4-dichlorophenyl)-2-[methyl(propan-2-yl)amino]acetamide
CID 17430297
N-(3,4-dichlorophenyl)-2-[methyl-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]amino]acetamide
CID 9198212
N-(3-chloro-4-methylphenyl)-2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanylacetamide
CID 8858057
N-(3,4-dichlorophenyl)-2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]acetamide
CID 27252298

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide (CID 9195215) is N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide is CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1nnnn1-c1ccccc1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
The InChIKey is VEXAEIUCWWFXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N6O/c1-23(10-15(25)19-11-7-8-13(17)14(18)9-11)16-20-21-22-24(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,25).
What are the key properties of N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide has a molecular weight of 377.24 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide is sourced from PubChem (CID 9195215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).