2-amino-5-methoxychromen-4-one

C10H9NO3 — CID 134860119

IUPAC2-amino-5-methoxychromen-4-one
SMILESCOc1cccc2oc(N)cc(=O)c12
InChIInChI=1S/C10H9NO3/c1-13-7-3-2-4-8-10(7)6(12)5-9(11)14-8/h2-5H,11H2,1H3
InChIKeyDATDJCOOTVTXTH-UHFFFAOYSA-N
MW191.19 g/mol
LogP1.38
Rot. Bonds1

About 2-amino-5-methoxychromen-4-one

2-amino-5-methoxychromen-4-one (PubChem CID 134860119) has the molecular formula C10H9NO3 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-amino-5-methoxychromen-4-one.

Molecular Properties

Compound Name2-amino-5-methoxychromen-4-one
PubChem CID134860119
Molecular FormulaC10H9NO3
Molecular Weight191.19 g/mol
Exact Mass191.06
IUPAC Name2-amino-5-methoxychromen-4-one
SMILESCOc1cccc2oc(N)cc(=O)c12
InChIInChI=1S/C10H9NO3/c1-13-7-3-2-4-8-10(7)6(12)5-9(11)14-8/h2-5H,11H2,1H3
InChIKeyDATDJCOOTVTXTH-UHFFFAOYSA-N
XLogP1.38
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-2-(trifluoromethyl)chromen-4-one
CID 134855912
2-(3-amino-4-methylphenyl)-5-methoxychromen-4-one
CID 71421837
5-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
CID 18761939
2-(3,4-dichlorophenyl)-5-methoxychromen-4-one
CID 10041721
5-methoxy-4-methylchromen-2-one
CID 11286956
5-methoxy-2-(2-methoxynaphthalen-1-yl)chromen-4-one
CID 142743418
3,4,5-trimethoxychromen-2-one
CID 19930053
5-hydroxy-2-(2-methoxyphenyl)chromen-4-one
CID 688677
1-hydroxy-3,4,8-trimethoxyxanthen-9-one
CID 162882586
7-hydroxy-1-methoxyxanthen-9-one
CID 10490332
[4-oxo-2-(3,4,5-trimethoxyphenyl)chromen-5-yl] acetate
CID 71413141
4-methoxy-1,3-benzoxathiol-2-one
CID 12563343

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxychromen-4-one?
The IUPAC name of 2-amino-5-methoxychromen-4-one (CID 134860119) is 2-amino-5-methoxychromen-4-one.
What is the SMILES notation for 2-amino-5-methoxychromen-4-one?
The canonical SMILES for 2-amino-5-methoxychromen-4-one is COc1cccc2oc(N)cc(=O)c12.
What is the InChIKey of 2-amino-5-methoxychromen-4-one?
The InChIKey is DATDJCOOTVTXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO3/c1-13-7-3-2-4-8-10(7)6(12)5-9(11)14-8/h2-5H,11H2,1H3.
What are the key properties of 2-amino-5-methoxychromen-4-one?
2-amino-5-methoxychromen-4-one has a molecular weight of 191.19 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxychromen-4-one is sourced from PubChem (CID 134860119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).