3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C14H14N6O2S — CID 91946133

IUPAC3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cccc(OCc3nnnn3C)c2)n1
InChIInChI=1S/C14H14N6O2S/c1-9-8-23-14(15-9)16-13(21)10-4-3-5-11(6-10)22-7-12-17-18-19-20(12)2/h3-6,8H,7H2,1-2H3,(H,15,16,21)
InChIKeyZNKIAURDFFKWRP-UHFFFAOYSA-N
MW330.37 g/mol
LogP1.81
Rot. Bonds5

About 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide

3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 91946133) has the molecular formula C14H14N6O2S and a molecular weight of 330.37 g/mol. Its IUPAC name is 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID91946133
Molecular FormulaC14H14N6O2S
Molecular Weight330.37 g/mol
Exact Mass330.09
IUPAC Name3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cccc(OCc3nnnn3C)c2)n1
InChIInChI=1S/C14H14N6O2S/c1-9-8-23-14(15-9)16-13(21)10-4-3-5-11(6-10)22-7-12-17-18-19-20(12)2/h3-6,8H,7H2,1-2H3,(H,15,16,21)
InChIKeyZNKIAURDFFKWRP-UHFFFAOYSA-N
XLogP1.81
TPSA94.82 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

3-(2-methylpropoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 30854706
3-(3-methylphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 44572247
3-[(1-methyltetrazol-5-yl)methoxy]-N-(pyridin-3-ylmethyl)benzamide
CID 71830494
N-(4-methyl-1,3-thiazol-2-yl)-3-pyridin-2-yloxybenzamide
CID 90596534
N-[3-(1-methyltetrazol-5-yl)phenyl]-3-(1,3-thiazol-4-ylmethoxy)benzamide
CID 41360644
3-cyano-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 7770854
3,5-bis[(2-fluorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 59735905
2-[[5-[(3-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 4059522
4-N-(4-methyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 47106736
(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone
CID 71830488
3-methoxy-N-[3-[(4-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl]benzamide
CID 17226207
ethyl 2-[[3-(2-methoxy-2-oxoethoxy)benzoyl]amino]-1,3-thiazole-4-carboxylate
CID 55883031

Frequently Asked Questions

What is the IUPAC name of 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 91946133) is 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide is Cc1csc(NC(=O)c2cccc(OCc3nnnn3C)c2)n1.
What is the InChIKey of 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is ZNKIAURDFFKWRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O2S/c1-9-8-23-14(15-9)16-13(21)10-4-3-5-11(6-10)22-7-12-17-18-19-20(12)2/h3-6,8H,7H2,1-2H3,(H,15,16,21).
What are the key properties of 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 330.37 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 91946133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).