N-methyl-6-methyliminoxanthen-3-amine

C15H14N2O — CID 17172

IUPACN-methyl-6-methyliminoxanthen-3-amine
SMILESC/N=c1\ccc2cc3ccc(NC)cc3oc-2c1
InChIInChI=1S/C15H14N2O/c1-16-12-5-3-10-7-11-4-6-13(17-2)9-15(11)18-14(10)8-12/h3-9,16H,1-2H3/b17-13+
InChIKeyAZJKFDJTOJCKAN-GHRIWEEISA-N
MW238.29 g/mol
LogP3.11
Rot. Bonds1

About N-methyl-6-methyliminoxanthen-3-amine

N-methyl-6-methyliminoxanthen-3-amine (PubChem CID 17172) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is N-methyl-6-methyliminoxanthen-3-amine.

Molecular Properties

Compound NameN-methyl-6-methyliminoxanthen-3-amine
PubChem CID17172
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC NameN-methyl-6-methyliminoxanthen-3-amine
SMILESC/N=c1\ccc2cc3ccc(NC)cc3oc-2c1
InChIInChI=1S/C15H14N2O/c1-16-12-5-3-10-7-11-4-6-13(17-2)9-15(11)18-14(10)8-12/h3-9,16H,1-2H3/b17-13+
InChIKeyAZJKFDJTOJCKAN-GHRIWEEISA-N
XLogP3.11
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

Pyronine
CID 7085
Pyronine B
CID 16524
Tetramethylrosamine
CID 2762681
2H-1-Benzopyran-2-one, 7-(ethylamino)-4-methyl-
CID 120061
3-[(4-iodophenyl)methoxy]-N-methylaniline
CID 76283251
Rosamine
CID 2762680
2H-1-Benzopyran-3-carboxamide, 7-(diethylamino)-2-imino-
CID 395945
[7-(Diethylamino)-4-methylchromen-2-ylidene]-phenylazanium
CID 45488738
[6-(Diethylamino)-2,7-difluoroxanthen-3-ylidene]-diethylazanium;2,2,2-trifluoroacetate
CID 168269425
pyronin Y cation
CID 7086
Ethanaminium, N-[6-(diethylamino)-3H-xanthen-3-ylidene]-N-ethyl-, chloride
CID 16525
Acridine red
CID 17171

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-methyliminoxanthen-3-amine?
The IUPAC name of N-methyl-6-methyliminoxanthen-3-amine (CID 17172) is N-methyl-6-methyliminoxanthen-3-amine.
What is the SMILES notation for N-methyl-6-methyliminoxanthen-3-amine?
The canonical SMILES for N-methyl-6-methyliminoxanthen-3-amine is C/N=c1\ccc2cc3ccc(NC)cc3oc-2c1.
What is the InChIKey of N-methyl-6-methyliminoxanthen-3-amine?
The InChIKey is AZJKFDJTOJCKAN-GHRIWEEISA-N. The full InChI is InChI=1S/C15H14N2O/c1-16-12-5-3-10-7-11-4-6-13(17-2)9-15(11)18-14(10)8-12/h3-9,16H,1-2H3/b17-13+.
What are the key properties of N-methyl-6-methyliminoxanthen-3-amine?
N-methyl-6-methyliminoxanthen-3-amine has a molecular weight of 238.29 g/mol, XLogP of 3.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-methyliminoxanthen-3-amine is sourced from PubChem (CID 17172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).