N-[3-methyl-2-(methylamino)phenyl]formamide

C9H12N2O — CID 142602610

IUPACN-[3-methyl-2-(methylamino)phenyl]formamide
SMILESCNc1c(C)cccc1NC=O
InChIInChI=1S/C9H12N2O/c1-7-4-3-5-8(11-6-12)9(7)10-2/h3-6,10H,1-2H3,(H,11,12)
InChIKeyNVOMTNKYQJDVCQ-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.61
Rot. Bonds3

About N-[3-methyl-2-(methylamino)phenyl]formamide

N-[3-methyl-2-(methylamino)phenyl]formamide (PubChem CID 142602610) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is N-[3-methyl-2-(methylamino)phenyl]formamide.

Molecular Properties

Compound NameN-[3-methyl-2-(methylamino)phenyl]formamide
PubChem CID142602610
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC NameN-[3-methyl-2-(methylamino)phenyl]formamide
SMILESCNc1c(C)cccc1NC=O
InChIInChI=1S/C9H12N2O/c1-7-4-3-5-8(11-6-12)9(7)10-2/h3-6,10H,1-2H3,(H,11,12)
InChIKeyNVOMTNKYQJDVCQ-UHFFFAOYSA-N
XLogP1.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-[3-methyl-2-(methylamino)phenyl]formamide
CID 142602609
N-(2,3-dimethylphenyl)formamide;methane
CID 143644303
2-[3-methyl-2-(methylamino)anilino]ethene-1,1,2-tricarbonitrile
CID 168607866
2-[4-(methylamino)phenyl]acetaldehyde;N-(2-methylphenyl)formamide
CID 143818637
N-(3-fluoro-2-methylphenyl)formamide
CID 45090567
acetaldehyde;N,2-dimethylaniline;ethane
CID 143317223
N-[2-(2-methylphenyl)-1,3-dioxoisoindol-4-yl]formamide
CID 168652528
2-(diethylamino)acetaldehyde;N,2,6-trimethylaniline
CID 145241841
N-(2-methyl-3-sulfamoylphenyl)formamide
CID 64992566
ethane;propanal;N,2,3-trimethylaniline
CID 154675662
N-(4-methylnaphthalen-1-yl)formamide
CID 72513878
2-fluoro-N,6-dimethylaniline;hydrochloride
CID 167737520

Frequently Asked Questions

What is the IUPAC name of N-[3-methyl-2-(methylamino)phenyl]formamide?
The IUPAC name of N-[3-methyl-2-(methylamino)phenyl]formamide (CID 142602610) is N-[3-methyl-2-(methylamino)phenyl]formamide.
What is the SMILES notation for N-[3-methyl-2-(methylamino)phenyl]formamide?
The canonical SMILES for N-[3-methyl-2-(methylamino)phenyl]formamide is CNc1c(C)cccc1NC=O.
What is the InChIKey of N-[3-methyl-2-(methylamino)phenyl]formamide?
The InChIKey is NVOMTNKYQJDVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-7-4-3-5-8(11-6-12)9(7)10-2/h3-6,10H,1-2H3,(H,11,12).
What are the key properties of N-[3-methyl-2-(methylamino)phenyl]formamide?
N-[3-methyl-2-(methylamino)phenyl]formamide has a molecular weight of 164.21 g/mol, XLogP of 1.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methyl-2-(methylamino)phenyl]formamide is sourced from PubChem (CID 142602610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).