7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one

C24H23NO4 — CID 9054180

IUPAC7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one
SMILESCOc1ccc2cc(CN(C)Cc3cc(=O)oc4cc(OC)ccc34)ccc2c1
InChIInChI=1S/C24H23NO4/c1-25(14-16-4-5-18-11-20(27-2)7-6-17(18)10-16)15-19-12-24(26)29-23-13-21(28-3)8-9-22(19)23/h4-13H,14-15H2,1-3H3
InChIKeyGGIDVGITHGTIFX-UHFFFAOYSA-N
MW389.45 g/mol
LogP4.60
Rot. Bonds6

About 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one

7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one (PubChem CID 9054180) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one.

Molecular Properties

Compound Name7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one
PubChem CID9054180
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one
SMILESCOc1ccc2cc(CN(C)Cc3cc(=O)oc4cc(OC)ccc34)ccc2c1
InChIInChI=1S/C24H23NO4/c1-25(14-16-4-5-18-11-20(27-2)7-6-17(18)10-16)15-19-12-24(26)29-23-13-21(28-3)8-9-22(19)23/h4-13H,14-15H2,1-3H3
InChIKeyGGIDVGITHGTIFX-UHFFFAOYSA-N
XLogP4.60
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-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-4-[[(3-methoxyphenyl)methyl-methylamino]methyl]chromen-2-one
CID 2690617
4-[[(4-methoxyphenyl)methyl-methylamino]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one
CID 27197380
7-methoxy-4-[[methyl(2-phenylethyl)amino]methyl]chromen-2-one
CID 11151459
4-(iodomethyl)-7-methoxychromen-2-one
CID 129188629
N-(4-fluorophenyl)-2-[(7-methoxy-2-oxochromen-4-yl)methyl-methylamino]acetamide
CID 9252835
(7-methoxy-2-oxochromen-4-yl)methyl-methylazanium
CID 8931836
N-cyclopropyl-2-[(7-methoxy-2-oxochromen-4-yl)methyl-methylamino]acetamide
CID 9053292
7-methoxy-4-[(N,2,5-trimethylanilino)methyl]chromen-2-one
CID 52689134
4-[[(3-methoxyphenyl)methyl-methylamino]methyl]-7-methyl-6-propan-2-ylchromen-2-one
CID 2656756
4-[[(4-ethylphenyl)methyl-methylamino]methyl]-7-methylchromen-2-one
CID 27205990
7-methoxy-4-[[1-(2-methoxyphenyl)ethyl-methylamino]methyl]chromen-2-one
CID 55628357
4-ethyl-7-[2-(4-methoxyphenoxy)ethoxy]chromen-2-one
CID 7699732

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one?
The IUPAC name of 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one (CID 9054180) is 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one.
What is the SMILES notation for 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one?
The canonical SMILES for 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one is COc1ccc2cc(CN(C)Cc3cc(=O)oc4cc(OC)ccc34)ccc2c1.
What is the InChIKey of 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one?
The InChIKey is GGIDVGITHGTIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO4/c1-25(14-16-4-5-18-11-20(27-2)7-6-17(18)10-16)15-19-12-24(26)29-23-13-21(28-3)8-9-22(19)23/h4-13H,14-15H2,1-3H3.
What are the key properties of 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one?
7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one has a molecular weight of 389.45 g/mol, XLogP of 4.60, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]chromen-2-one is sourced from PubChem (CID 9054180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).