benzamide;hydron

C7H8NO+ — CID 68819060

IUPACbenzamide;hydron
SMILESNC(=O)c1ccccc1.[H+]
InChIInChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)/p+1
InChIKeyKXDAEFPNCMNJSK-UHFFFAOYSA-O
MW122.15 g/mol
LogP0.90
Rot. Bonds1

About benzamide;hydron

benzamide;hydron (PubChem CID 68819060) has the molecular formula C7H8NO+ and a molecular weight of 122.15 g/mol. Its IUPAC name is benzamide;hydron.

Molecular Properties

Compound Namebenzamide;hydron
PubChem CID68819060
Molecular FormulaC7H8NO+
Molecular Weight122.15 g/mol
Exact Mass122.06
IUPAC Namebenzamide;hydron
SMILESNC(=O)c1ccccc1.[H+]
InChIInChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)/p+1
InChIKeyKXDAEFPNCMNJSK-UHFFFAOYSA-O
XLogP0.90
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.15
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

CID 67738089
CID 67738089
benzamide;ethene
CID 143479548
dipotassium;benzamide;carbonate
CID 159256468
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CID 174591280
benzamide;trifluoroborane
CID 158302663
acetyl chloride;benzamide
CID 160666659
benzamide;2,3-dimethylbutane
CID 162214835
benzamide;pyrazine
CID 67119172
sodium;benzamide;benzoic acid;hydride
CID 175327257
benzamide;pyridine-4-carboxamide
CID 175267661
benzamide;thiophene
CID 67043300
benzamide;2,2,2-trichloroacetic acid
CID 70538723

Frequently Asked Questions

What is the IUPAC name of benzamide;hydron?
The IUPAC name of benzamide;hydron (CID 68819060) is benzamide;hydron.
What is the SMILES notation for benzamide;hydron?
The canonical SMILES for benzamide;hydron is NC(=O)c1ccccc1.[H+].
What is the InChIKey of benzamide;hydron?
The InChIKey is KXDAEFPNCMNJSK-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)/p+1.
What are the key properties of benzamide;hydron?
benzamide;hydron has a molecular weight of 122.15 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzamide;hydron is sourced from PubChem (CID 68819060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).