N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide

C10H12N2O2 — CID 134105298

IUPACN-[3-[formyl(methyl)amino]phenyl]-N-methylformamide
SMILESCN(C=O)c1cccc(N(C)C=O)c1
InChIInChI=1S/C10H12N2O2/c1-11(7-13)9-4-3-5-10(6-9)12(2)8-14/h3-8H,1-2H3
InChIKeyIIGTUPLVCWBTAO-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.87
Rot. Bonds4

About N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide

N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide (PubChem CID 134105298) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide.

Molecular Properties

Compound NameN-[3-[formyl(methyl)amino]phenyl]-N-methylformamide
PubChem CID134105298
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC NameN-[3-[formyl(methyl)amino]phenyl]-N-methylformamide
SMILESCN(C=O)c1cccc(N(C)C=O)c1
InChIInChI=1S/C10H12N2O2/c1-11(7-13)9-4-3-5-10(6-9)12(2)8-14/h3-8H,1-2H3
InChIKeyIIGTUPLVCWBTAO-UHFFFAOYSA-N
XLogP0.87
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N-[3-(trifluoromethyl)phenyl]formamide
CID 162541615
3-methylaniline;N-methyl-N-phenylformamide
CID 174963220
3-[formyl(methyl)amino]-N-(4-formylphenyl)benzamide
CID 145184822
N-(4-aminophenyl)-N-methylformamide
CID 19983561
ethane;1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
CID 90858464
N-methyl-N-[3-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]formamide
CID 15595684
N-methyl-N-(4-phenyldiazenylphenyl)formamide
CID 20987
N,N-dibutylformamide;N-methyl-N-phenylformamide
CID 23174930
N,N-dimethylformamide;1,3-xylene
CID 175545564
N-[4-[formyl(methyl)amino]phenyl]formamide
CID 122630608
N-[2-(dimethylamino)phenyl]-N-methylformamide
CID 142965400
N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-N-methylformamide
CID 142172508

Frequently Asked Questions

What is the IUPAC name of N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide?
The IUPAC name of N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide (CID 134105298) is N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide.
What is the SMILES notation for N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide?
The canonical SMILES for N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide is CN(C=O)c1cccc(N(C)C=O)c1.
What is the InChIKey of N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide?
The InChIKey is IIGTUPLVCWBTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-11(7-13)9-4-3-5-10(6-9)12(2)8-14/h3-8H,1-2H3.
What are the key properties of N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide?
N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide has a molecular weight of 192.22 g/mol, XLogP of 0.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[formyl(methyl)amino]phenyl]-N-methylformamide is sourced from PubChem (CID 134105298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).