N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide

C17H17ClN6O2 — CID 4788437

IUPACN-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN(C)c1nnnn1-c1ccccc1
InChIInChI=1S/C17H17ClN6O2/c1-23(17-20-21-22-24(17)13-6-4-3-5-7-13)11-16(25)19-14-10-12(18)8-9-15(14)26-2/h3-10H,11H2,1-2H3,(H,19,25)
InChIKeySMJOQEJJBKHKPX-UHFFFAOYSA-N
MW372.82 g/mol
LogP2.40
Rot. Bonds6

About N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide

N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide (PubChem CID 4788437) has the molecular formula C17H17ClN6O2 and a molecular weight of 372.82 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
PubChem CID4788437
Molecular FormulaC17H17ClN6O2
Molecular Weight372.82 g/mol
Exact Mass372.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN(C)c1nnnn1-c1ccccc1
InChIInChI=1S/C17H17ClN6O2/c1-23(17-20-21-22-24(17)13-6-4-3-5-7-13)11-16(25)19-14-10-12(18)8-9-15(14)26-2/h3-10H,11H2,1-2H3,(H,19,25)
InChIKeySMJOQEJJBKHKPX-UHFFFAOYSA-N
XLogP2.40
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.82
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
CID 9195215
N-(5-chloro-2-methoxyphenyl)-2-(3,4-difluoro-N-methylanilino)acetamide
CID 60573040
2-[[2-(5-chloro-2-fluoroanilino)-2-oxoethyl]-methylamino]-N-(5-chloro-2-methoxyphenyl)acetamide
CID 9222334
N-(5-chloro-2-methoxyphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 2947640
2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-ethylamino]-N-(2-methoxyphenyl)acetamide
CID 9029907
N-(5-chloro-2-methoxyphenyl)-2-[[2-(2,6-diethylanilino)-2-oxoethyl]-methylamino]acetamide
CID 9222409
N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-N-methylacetamide
CID 8501233
2-[2-aminoethyl(methyl)amino]-N-(5-chloro-2-methoxyphenyl)acetamide
CID 62686650
2-[acetyl(propan-2-yl)amino]-N-(5-chloro-2-methoxyphenyl)acetamide
CID 113158224
N-(5-chloro-2-methoxyphenyl)-2-[[3-(methoxymethyl)-1,2,4-thiadiazol-5-yl]-methylamino]acetamide
CID 133352469
N-(5-chloro-2-methoxyphenyl)-1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxamide
CID 20892594
N-benzyl-2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]propanamide
CID 51167337

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide (CID 4788437) is N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide is COc1ccc(Cl)cc1NC(=O)CN(C)c1nnnn1-c1ccccc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
The InChIKey is SMJOQEJJBKHKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN6O2/c1-23(17-20-21-22-24(17)13-6-4-3-5-7-13)11-16(25)19-14-10-12(18)8-9-15(14)26-2/h3-10H,11H2,1-2H3,(H,19,25).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide?
N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide has a molecular weight of 372.82 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide is sourced from PubChem (CID 4788437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).