N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide

C16H15N5O — CID 7465186

IUPACN-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
SMILESCCc1ccc(NC(=O)c2ccc(-n3cnnn3)cc2)cc1
InChIInChI=1S/C16H15N5O/c1-2-12-3-7-14(8-4-12)18-16(22)13-5-9-15(10-6-13)21-11-17-19-20-21/h3-11H,2H2,1H3,(H,18,22)
InChIKeyWQPZBOVGXJYYTM-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.48
Rot. Bonds4

About N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide

N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide (PubChem CID 7465186) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
PubChem CID7465186
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC NameN-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
SMILESCCc1ccc(NC(=O)c2ccc(-n3cnnn3)cc2)cc1
InChIInChI=1S/C16H15N5O/c1-2-12-3-7-14(8-4-12)18-16(22)13-5-9-15(10-6-13)21-11-17-19-20-21/h3-11H,2H2,1H3,(H,18,22)
InChIKeyWQPZBOVGXJYYTM-UHFFFAOYSA-N
XLogP2.48
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-iodo-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 26729235
N-[4-(tetrazol-1-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 7930055
4-(tetrazol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide
CID 31957653
N-[4-(tetrazol-1-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide
CID 43038170
N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-4-(tetrazol-1-yl)benzamide
CID 7465223
4-nitro-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 17011174
4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 26729233
N-(4-ethylphenyl)-4-(5-methylsulfanyltetrazol-1-yl)benzamide
CID 46377493
N-[4-[[4-(tetrazol-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 9450376
4-ethyl-5-methyl-N-[4-(tetrazol-1-yl)phenyl]thiophene-2-carboxamide
CID 17419224
4-(tetrazol-1-yl)benzohydrazide
CID 2114009
[2-(4-ethylphenyl)-2-oxoethyl] 4-(tetrazol-1-yl)benzoate
CID 2535527

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide (CID 7465186) is N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide is CCc1ccc(NC(=O)c2ccc(-n3cnnn3)cc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide?
The InChIKey is WQPZBOVGXJYYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c1-2-12-3-7-14(8-4-12)18-16(22)13-5-9-15(10-6-13)21-11-17-19-20-21/h3-11H,2H2,1H3,(H,18,22).
What are the key properties of N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide?
N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide has a molecular weight of 293.33 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 7465186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).