8-methoxynaphtho[1,2-c]chromen-5-one

C18H12O3 — CID 118617567

IUPAC8-methoxynaphtho[1,2-c]chromen-5-one
SMILESCOc1ccc2c(c1)oc(=O)c1c3ccccc3ccc21
InChIInChI=1S/C18H12O3/c1-20-12-7-9-14-15-8-6-11-4-2-3-5-13(11)17(15)18(19)21-16(14)10-12/h2-10H,1H3
InChIKeyWHXBVXBONYOYSD-UHFFFAOYSA-N
MW276.29 g/mol
LogP4.11
Rot. Bonds1

About 8-methoxynaphtho[1,2-c]chromen-5-one

8-methoxynaphtho[1,2-c]chromen-5-one (PubChem CID 118617567) has the molecular formula C18H12O3 and a molecular weight of 276.29 g/mol. Its IUPAC name is 8-methoxynaphtho[1,2-c]chromen-5-one.

Molecular Properties

Compound Name8-methoxynaphtho[1,2-c]chromen-5-one
PubChem CID118617567
Molecular FormulaC18H12O3
Molecular Weight276.29 g/mol
Exact Mass276.08
IUPAC Name8-methoxynaphtho[1,2-c]chromen-5-one
SMILESCOc1ccc2c(c1)oc(=O)c1c3ccccc3ccc21
InChIInChI=1S/C18H12O3/c1-20-12-7-9-14-15-8-6-11-4-2-3-5-13(11)17(15)18(19)21-16(14)10-12/h2-10H,1H3
InChIKeyWHXBVXBONYOYSD-UHFFFAOYSA-N
XLogP4.11
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

7-methoxy-4-oxapentacyclo[12.8.0.02,11.05,10.015,20]docosa-1(14),2(11),5(10),6,8,12,15,17,19,21-decaen-3-one
CID 118617487
7-methoxy-4-oxahexacyclo[12.12.0.02,11.05,10.015,20.021,26]hexacosa-1(14),2(11),5(10),6,8,12,15,17,19,21,23,25-dodecaen-3-one
CID 118617499
naphtho[1,2-c]chromen-5-one
CID 102526290
2-methoxy-[1]benzofuro[3,2-c]chromen-6-one
CID 110272886
9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran
CID 155128175
8-methoxy-3-[(4-methoxyphenyl)methoxy]benzo[c]chromen-6-one
CID 1347567
3-hydroxy-7-methoxy-4-phenylmethoxychromen-2-one
CID 22402268
6-methoxy-10-methyl-12-oxa-9-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene
CID 170838380
3-chloro-8-methoxybenzo[c]chromen-6-one
CID 164598037
9-methoxy-[1]benzothiolo[3,2-c]chromen-6-one
CID 54450197
17-methyl-12,20-dioxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17-nonaen-21-one
CID 118531175
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CID 131750884

Frequently Asked Questions

What is the IUPAC name of 8-methoxynaphtho[1,2-c]chromen-5-one?
The IUPAC name of 8-methoxynaphtho[1,2-c]chromen-5-one (CID 118617567) is 8-methoxynaphtho[1,2-c]chromen-5-one.
What is the SMILES notation for 8-methoxynaphtho[1,2-c]chromen-5-one?
The canonical SMILES for 8-methoxynaphtho[1,2-c]chromen-5-one is COc1ccc2c(c1)oc(=O)c1c3ccccc3ccc21.
What is the InChIKey of 8-methoxynaphtho[1,2-c]chromen-5-one?
The InChIKey is WHXBVXBONYOYSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12O3/c1-20-12-7-9-14-15-8-6-11-4-2-3-5-13(11)17(15)18(19)21-16(14)10-12/h2-10H,1H3.
What are the key properties of 8-methoxynaphtho[1,2-c]chromen-5-one?
8-methoxynaphtho[1,2-c]chromen-5-one has a molecular weight of 276.29 g/mol, XLogP of 4.11, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxynaphtho[1,2-c]chromen-5-one is sourced from PubChem (CID 118617567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).