N-(2,3-dimethylphenyl)formamide;methane

C10H15NO — CID 143644303

IUPACN-(2,3-dimethylphenyl)formamide;methane
SMILESC.Cc1cccc(NC=O)c1C
InChIInChI=1S/C9H11NO.CH4/c1-7-4-3-5-9(8(7)2)10-6-11;/h3-6H,1-2H3,(H,10,11);1H4
InChIKeyCLQALEJHJKCSGP-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.51
Rot. Bonds2

About N-(2,3-dimethylphenyl)formamide;methane

N-(2,3-dimethylphenyl)formamide;methane (PubChem CID 143644303) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)formamide;methane.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)formamide;methane
PubChem CID143644303
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN-(2,3-dimethylphenyl)formamide;methane
SMILESC.Cc1cccc(NC=O)c1C
InChIInChI=1S/C9H11NO.CH4/c1-7-4-3-5-9(8(7)2)10-6-11;/h3-6H,1-2H3,(H,10,11);1H4
InChIKeyCLQALEJHJKCSGP-UHFFFAOYSA-N
XLogP2.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(3-fluoro-2-methylphenyl)formamide
CID 45090567
N-ethenyl-2,3-dimethylaniline
CID 70358153
N-[3-methyl-2-(methylamino)phenyl]formamide
CID 142602610
ethane;N-[3-methyl-2-(methylamino)phenyl]formamide
CID 142602609
N-(2-methyl-3-sulfamoylphenyl)formamide
CID 64992566
2-(2,3-dimethylanilino)benzaldehyde
CID 15027376
ethane;propanal;N,2,3-trimethylaniline
CID 154675662
methane;1,2,3-trimethylbenzene;1,2-xylene
CID 157250417
ethane;1,2,3-trimethylbenzene
CID 54068667
benzene;1,2,3-trimethylbenzene
CID 159605245
phosphenous acid;1,2,3-trimethylbenzene
CID 174913168
N-(2,3-dimethyl-1H-indol-7-yl)formamide
CID 174861152

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)formamide;methane?
The IUPAC name of N-(2,3-dimethylphenyl)formamide;methane (CID 143644303) is N-(2,3-dimethylphenyl)formamide;methane.
What is the SMILES notation for N-(2,3-dimethylphenyl)formamide;methane?
The canonical SMILES for N-(2,3-dimethylphenyl)formamide;methane is C.Cc1cccc(NC=O)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)formamide;methane?
The InChIKey is CLQALEJHJKCSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO.CH4/c1-7-4-3-5-9(8(7)2)10-6-11;/h3-6H,1-2H3,(H,10,11);1H4.
What are the key properties of N-(2,3-dimethylphenyl)formamide;methane?
N-(2,3-dimethylphenyl)formamide;methane has a molecular weight of 165.24 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)formamide;methane is sourced from PubChem (CID 143644303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).