N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide

C10H11N5O2 — CID 44615707

IUPACN-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1-n1cnnn1
InChIInChI=1S/C10H11N5O2/c1-7(16)12-8-3-4-10(17-2)9(5-8)15-6-11-13-14-15/h3-6H,1-2H3,(H,12,16)
InChIKeyBIGGSDDJQHEEAD-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.63
Rot. Bonds3

About N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide

N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 44615707) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
PubChem CID44615707
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC NameN-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1-n1cnnn1
InChIInChI=1S/C10H11N5O2/c1-7(16)12-8-3-4-10(17-2)9(5-8)15-6-11-13-14-15/h3-6H,1-2H3,(H,12,16)
InChIKeyBIGGSDDJQHEEAD-UHFFFAOYSA-N
XLogP0.63
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,4,5-trimethoxy-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]benzamide
CID 50776858
N-[4-methoxy-3-(tetrazol-1-yl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119798049
N-[4-methoxy-3-(tetrazol-1-yl)phenyl]-3-methylbutanamide
CID 45491400
(2S)-2-amino-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]-3,3-dimethylbutanamide
CID 119798054
5-bromo-2-methoxy-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]benzamide
CID 50776873
3-(3,4-dimethoxyphenyl)-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]propanamide
CID 45494122
5-(dimethylamino)-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]-4-methylpentanamide
CID 167966168
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
CID 119798058
2-[(1S,2R,6R,7S,8R,10S)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
CID 124765599
2-[(1S,2S,6R,7S,8R,10R)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
CID 124765602
N-[4-methoxy-3-(tetrazol-1-yl)phenyl]-3-(2-phenylphenoxy)propanamide
CID 154861700
N-[4-(2-methoxyethoxy)-3-(tetrazol-1-yl)phenyl]pyridine-4-carboxamide
CID 154635315

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide (CID 44615707) is N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide is COc1ccc(NC(C)=O)cc1-n1cnnn1.
What is the InChIKey of N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is BIGGSDDJQHEEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-7(16)12-8-3-4-10(17-2)9(5-8)15-6-11-13-14-15/h3-6H,1-2H3,(H,12,16).
What are the key properties of N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide?
N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 233.23 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 44615707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).