2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide

C12H17N3O3 — CID 74241829

IUPAC2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide
SMILESCNC(=O)Nc1ccc(OC)c(C(=O)N(C)C)c1
InChIInChI=1S/C12H17N3O3/c1-13-12(17)14-8-5-6-10(18-4)9(7-8)11(16)15(2)3/h5-7H,1-4H3,(H2,13,14,17)
InChIKeyAQTWQQDHSFJNHG-UHFFFAOYSA-N
MW251.29 g/mol
LogP1.15
Rot. Bonds3

About 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide

2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide (PubChem CID 74241829) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide.

Molecular Properties

Compound Name2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide
PubChem CID74241829
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide
SMILESCNC(=O)Nc1ccc(OC)c(C(=O)N(C)C)c1
InChIInChI=1S/C12H17N3O3/c1-13-12(17)14-8-5-6-10(18-4)9(7-8)11(16)15(2)3/h5-7H,1-4H3,(H2,13,14,17)
InChIKeyAQTWQQDHSFJNHG-UHFFFAOYSA-N
XLogP1.15
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cyclobutanecarbonylamino)-2-methoxy-N,N-dimethylbenzamide
CID 131935340
5-[2-(4,6-dimethylpyrimidin-2-yl)ethylcarbamoylamino]-2-methoxy-N,N-dimethylbenzamide
CID 72871754
3-chloro-N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]pyridine-4-carboxamide
CID 131944597
N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
CID 131925260
2-methoxy-N,N-dimethyl-5-[(4-propoxybenzoyl)amino]benzamide
CID 131921286
5-[2-(dicyanomethylidene)hydrazinyl]-2-methoxy-N,N-dimethylbenzamide
CID 169338345
5-[2-(2,3-dihydroindol-1-yl)ethylcarbamoylamino]-2-methoxy-N,N-dimethylbenzamide
CID 74248773
N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]-1-methylpiperidine-3-carboxamide
CID 131939950
N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
CID 131939884
N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]-2-pyridin-2-ylpyrimidine-5-carboxamide
CID 131927307
5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-2-methoxy-N,N-dimethylbenzamide
CID 168537487
N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide
CID 131933497

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide?
The IUPAC name of 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide (CID 74241829) is 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide.
What is the SMILES notation for 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide?
The canonical SMILES for 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide is CNC(=O)Nc1ccc(OC)c(C(=O)N(C)C)c1.
What is the InChIKey of 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide?
The InChIKey is AQTWQQDHSFJNHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c1-13-12(17)14-8-5-6-10(18-4)9(7-8)11(16)15(2)3/h5-7H,1-4H3,(H2,13,14,17).
What are the key properties of 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide?
2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide has a molecular weight of 251.29 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,N-dimethyl-5-(methylcarbamoylamino)benzamide is sourced from PubChem (CID 74241829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).