3-amino-7-methoxy-2-phenylchromen-4-one

C16H13NO3 — CID 101481005

IUPAC3-amino-7-methoxy-2-phenylchromen-4-one
SMILESCOc1ccc2c(=O)c(N)c(-c3ccccc3)oc2c1
InChIInChI=1S/C16H13NO3/c1-19-11-7-8-12-13(9-11)20-16(14(17)15(12)18)10-5-3-2-4-6-10/h2-9H,17H2,1H3
InChIKeyITOYZDMXJVOSJD-UHFFFAOYSA-N
MW267.28 g/mol
LogP3.05
Rot. Bonds2

About 3-amino-7-methoxy-2-phenylchromen-4-one

3-amino-7-methoxy-2-phenylchromen-4-one (PubChem CID 101481005) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is 3-amino-7-methoxy-2-phenylchromen-4-one.

Molecular Properties

Compound Name3-amino-7-methoxy-2-phenylchromen-4-one
PubChem CID101481005
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name3-amino-7-methoxy-2-phenylchromen-4-one
SMILESCOc1ccc2c(=O)c(N)c(-c3ccccc3)oc2c1
InChIInChI=1S/C16H13NO3/c1-19-11-7-8-12-13(9-11)20-16(14(17)15(12)18)10-5-3-2-4-6-10/h2-9H,17H2,1H3
InChIKeyITOYZDMXJVOSJD-UHFFFAOYSA-N
XLogP3.05
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-amino-7-methoxy-2-phenylchromen-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-methoxy-3-phenyl-2-(trifluoromethyl)chromen-4-one
CID 746442
7-methoxy-2-(4-methoxyphenyl)-4-oxochromene-3-carbonitrile
CID 71378369
2-(4-methoxyphenyl)-1-benzofuran-3-amine
CID 102535586
2-[3,5-bis(4-aminophenoxy)phenyl]-7-methoxy-3-methylchromen-4-one
CID 139992545
6-methoxy-2-methyl-3-phenyl-1-benzofuran
CID 3448866
3-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxychromen-4-one
CID 10807373
[4-(7-methoxy-3-methyl-4-oxochromen-2-yl)phenyl] 3,5-diaminobenzoate
CID 139992676
2-bromo-6-methoxy-3-phenyl-1-benzofuran
CID 21436790
5-hydroxy-3,7-dimethoxy-2-phenylchromen-4-one
CID 139068259
3-methoxy-2-phenyl-7-[3-(propan-2-ylamino)propoxy]chromen-4-one
CID 10384334
3-iodo-6-methoxy-2-(4-methoxyphenyl)-1-benzofuran
CID 50943995
3-benzoyl-2-(2-bromophenyl)-7-methoxychromen-4-one
CID 86225439

Frequently Asked Questions

What is the IUPAC name of 3-amino-7-methoxy-2-phenylchromen-4-one?
The IUPAC name of 3-amino-7-methoxy-2-phenylchromen-4-one (CID 101481005) is 3-amino-7-methoxy-2-phenylchromen-4-one.
What is the SMILES notation for 3-amino-7-methoxy-2-phenylchromen-4-one?
The canonical SMILES for 3-amino-7-methoxy-2-phenylchromen-4-one is COc1ccc2c(=O)c(N)c(-c3ccccc3)oc2c1.
What is the InChIKey of 3-amino-7-methoxy-2-phenylchromen-4-one?
The InChIKey is ITOYZDMXJVOSJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-19-11-7-8-12-13(9-11)20-16(14(17)15(12)18)10-5-3-2-4-6-10/h2-9H,17H2,1H3.
What are the key properties of 3-amino-7-methoxy-2-phenylchromen-4-one?
3-amino-7-methoxy-2-phenylchromen-4-one has a molecular weight of 267.28 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-7-methoxy-2-phenylchromen-4-one is sourced from PubChem (CID 101481005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).