3-(methylamino)benzamide

C8H10N2O — CID 18727714

IUPAC3-(methylamino)benzamide
SMILESCNc1cccc(C(N)=O)c1
InChIInChI=1S/C8H10N2O/c1-10-7-4-2-3-6(5-7)8(9)11/h2-5,10H,1H3,(H2,9,11)
InChIKeyNZZZOYVRPOWZJQ-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.83
Rot. Bonds2

About 3-(methylamino)benzamide

3-(methylamino)benzamide (PubChem CID 18727714) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-(methylamino)benzamide.

Molecular Properties

Compound Name3-(methylamino)benzamide
PubChem CID18727714
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-(methylamino)benzamide
SMILESCNc1cccc(C(N)=O)c1
InChIInChI=1S/C8H10N2O/c1-10-7-4-2-3-6(5-7)8(9)11/h2-5,10H,1H3,(H2,9,11)
InChIKeyNZZZOYVRPOWZJQ-UHFFFAOYSA-N
XLogP0.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;3-(methylamino)benzamide
CID 142071023
3-(methylamino)benzoic acid;hydrochloride
CID 55250935
[3-(methylamino)phenyl]-phenylmethanone
CID 19894083
3-hydrazinylbenzamide;hydrochloride
CID 90487444
[3-(methylamino)phenyl]urea
CID 23558981
N,N-dimethyl-3-(methylamino)benzamide;ethane
CID 91408702
3-(methanesulfinamido)benzamide
CID 169217991
3-(sulfamoylamino)benzamide
CID 57051238
3-(cyanoamino)benzamide
CID 19926828
3-(trifluoromethylamino)benzamide
CID 150882306
methyl 3-[3-(methylamino)phenyl]-3-oxopropanoate
CID 54055806
(3,4-dimethylphenyl)-[3-(methylamino)phenyl]methanone
CID 116917283

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)benzamide?
The IUPAC name of 3-(methylamino)benzamide (CID 18727714) is 3-(methylamino)benzamide.
What is the SMILES notation for 3-(methylamino)benzamide?
The canonical SMILES for 3-(methylamino)benzamide is CNc1cccc(C(N)=O)c1.
What is the InChIKey of 3-(methylamino)benzamide?
The InChIKey is NZZZOYVRPOWZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-10-7-4-2-3-6(5-7)8(9)11/h2-5,10H,1H3,(H2,9,11).
What are the key properties of 3-(methylamino)benzamide?
3-(methylamino)benzamide has a molecular weight of 150.18 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)benzamide is sourced from PubChem (CID 18727714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).