4-benzamido-5-methoxy-2-methylbenzenediazonium

C15H14N3O2+ — CID 23558418

IUPAC4-benzamido-5-methoxy-2-methylbenzenediazonium
SMILESCOc1cc([N+]#N)c(C)cc1NC(=O)c1ccccc1
InChIInChI=1S/C15H13N3O2/c1-10-8-13(14(20-2)9-12(10)18-16)17-15(19)11-6-4-3-5-7-11/h3-9H,1-2H3/p+1
InChIKeyMFZIPHXHLADJTP-UHFFFAOYSA-O
MW268.30 g/mol
LogP3.74
Rot. Bonds3

About 4-benzamido-5-methoxy-2-methylbenzenediazonium

4-benzamido-5-methoxy-2-methylbenzenediazonium (PubChem CID 23558418) has the molecular formula C15H14N3O2+ and a molecular weight of 268.30 g/mol. Its IUPAC name is 4-benzamido-5-methoxy-2-methylbenzenediazonium.

Molecular Properties

Compound Name4-benzamido-5-methoxy-2-methylbenzenediazonium
PubChem CID23558418
Molecular FormulaC15H14N3O2+
Molecular Weight268.30 g/mol
Exact Mass268.11
IUPAC Name4-benzamido-5-methoxy-2-methylbenzenediazonium
SMILESCOc1cc([N+]#N)c(C)cc1NC(=O)c1ccccc1
InChIInChI=1S/C15H13N3O2/c1-10-8-13(14(20-2)9-12(10)18-16)17-15(19)11-6-4-3-5-7-11/h3-9H,1-2H3/p+1
InChIKeyMFZIPHXHLADJTP-UHFFFAOYSA-O
XLogP3.74
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.30
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Related Compounds

N-(4-benzamido-2,5-dimethoxyphenyl)benzamide
CID 1053126
N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide
CID 3546373
N-[4-(fluoroamino)-2,5-dimethoxyphenyl]benzamide
CID 142075014
N-(5-chloro-2,4-dimethoxyphenyl)benzamide
CID 835257
4-benzamido-2,5-diethoxybenzenediazonium;dichlorozinc;chloride
CID 133108940
N-(4-amino-2,5-dimethoxyphenyl)benzamide;ethane;molecular hydrogen
CID 142075017
N-(2-amino-5-methoxy-4-methylphenyl)benzamide;hydrochloride
CID 172831967
N-(4-benzamido-2-methoxy-5-methylphenyl)thiophene-2-carboxamide
CID 4304532
N-(4-benzamido-2,5-dimethoxyphenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 16644290
ethyl 4-(4-benzamido-2,5-dimethoxyanilino)-4-oxobutanoate
CID 9087779
N-(2-methoxy-4,5-dimethylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110776827
4-benzamido-2,5-dimethoxybenzenesulfonic acid
CID 102438408

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-5-methoxy-2-methylbenzenediazonium?
The IUPAC name of 4-benzamido-5-methoxy-2-methylbenzenediazonium (CID 23558418) is 4-benzamido-5-methoxy-2-methylbenzenediazonium.
What is the SMILES notation for 4-benzamido-5-methoxy-2-methylbenzenediazonium?
The canonical SMILES for 4-benzamido-5-methoxy-2-methylbenzenediazonium is COc1cc([N+]#N)c(C)cc1NC(=O)c1ccccc1.
What is the InChIKey of 4-benzamido-5-methoxy-2-methylbenzenediazonium?
The InChIKey is MFZIPHXHLADJTP-UHFFFAOYSA-O. The full InChI is InChI=1S/C15H13N3O2/c1-10-8-13(14(20-2)9-12(10)18-16)17-15(19)11-6-4-3-5-7-11/h3-9H,1-2H3/p+1.
What are the key properties of 4-benzamido-5-methoxy-2-methylbenzenediazonium?
4-benzamido-5-methoxy-2-methylbenzenediazonium has a molecular weight of 268.30 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-5-methoxy-2-methylbenzenediazonium is sourced from PubChem (CID 23558418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).