methanamine;2-methylchromen-4-one

C11H13NO2 — CID 91311034

IUPACmethanamine;2-methylchromen-4-one
SMILESCN.Cc1cc(=O)c2ccccc2o1
InChIInChI=1S/C10H8O2.CH5N/c1-7-6-9(11)8-4-2-3-5-10(8)12-7;1-2/h2-6H,1H3;2H2,1H3
InChIKeyYEQQYFBLSPVACI-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.68
Rot. Bonds

About methanamine;2-methylchromen-4-one

methanamine;2-methylchromen-4-one (PubChem CID 91311034) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is methanamine;2-methylchromen-4-one.

Molecular Properties

Compound Namemethanamine;2-methylchromen-4-one
PubChem CID91311034
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Namemethanamine;2-methylchromen-4-one
SMILESCN.Cc1cc(=O)c2ccccc2o1
InChIInChI=1S/C10H8O2.CH5N/c1-7-6-9(11)8-4-2-3-5-10(8)12-7;1-2/h2-6H,1H3;2H2,1H3
InChIKeyYEQQYFBLSPVACI-UHFFFAOYSA-N
XLogP1.68
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,7-dimethylchromen-4-one
CID 2343140
2-methyl-7-sulfanylchromen-4-one
CID 15171696
2-(2-methylphenyl)chromen-4-one
CID 776385
8-amino-2-methylchromen-4-one
CID 147973217
2-methylsulfinylchromen-4-one
CID 86198403
2-phenylchromen-4-one
CID 90124083
2-(hydroxymethyl)chromen-4-one
CID 12536095
2-[(2Z,4Z)-2-hydroxyhexa-2,4-dien-3-yl]chromen-4-one
CID 142130778
4-oxo-N,N-di(propan-2-yl)chromene-2-carboxamide
CID 15041163
2-methyl-7-(trifluoromethyl)chromen-4-one
CID 125486339
2-(ethylamino)chromen-4-one
CID 86025135
2-methyl-4-oxochromene-7-carboxylic acid
CID 166609828

Frequently Asked Questions

What is the IUPAC name of methanamine;2-methylchromen-4-one?
The IUPAC name of methanamine;2-methylchromen-4-one (CID 91311034) is methanamine;2-methylchromen-4-one.
What is the SMILES notation for methanamine;2-methylchromen-4-one?
The canonical SMILES for methanamine;2-methylchromen-4-one is CN.Cc1cc(=O)c2ccccc2o1.
What is the InChIKey of methanamine;2-methylchromen-4-one?
The InChIKey is YEQQYFBLSPVACI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O2.CH5N/c1-7-6-9(11)8-4-2-3-5-10(8)12-7;1-2/h2-6H,1H3;2H2,1H3.
What are the key properties of methanamine;2-methylchromen-4-one?
methanamine;2-methylchromen-4-one has a molecular weight of 191.23 g/mol, XLogP of 1.68, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;2-methylchromen-4-one is sourced from PubChem (CID 91311034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).