2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid

C24H17NO5 — CID 146048783

IUPAC2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid
SMILESCOc1ccc2cc(-c3oc4c(c3CC(=O)O)c(=O)[nH]c3ccccc34)ccc2c1
InChIInChI=1S/C24H17NO5/c1-29-16-9-8-13-10-15(7-6-14(13)11-16)22-18(12-20(26)27)21-23(30-22)17-4-2-3-5-19(17)25-24(21)28/h2-11H,12H2,1H3,(H,25,28)(H,26,27)
InChIKeyLHYCTCLSSKUHGK-UHFFFAOYSA-N
MW399.40 g/mol
LogP4.73
Rot. Bonds4

About 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid

2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid (PubChem CID 146048783) has the molecular formula C24H17NO5 and a molecular weight of 399.40 g/mol. Its IUPAC name is 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid
PubChem CID146048783
Molecular FormulaC24H17NO5
Molecular Weight399.40 g/mol
Exact Mass399.11
IUPAC Name2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid
SMILESCOc1ccc2cc(-c3oc4c(c3CC(=O)O)c(=O)[nH]c3ccccc34)ccc2c1
InChIInChI=1S/C24H17NO5/c1-29-16-9-8-13-10-15(7-6-14(13)11-16)22-18(12-20(26)27)21-23(30-22)17-4-2-3-5-19(17)25-24(21)28/h2-11H,12H2,1H3,(H,25,28)(H,26,27)
InChIKeyLHYCTCLSSKUHGK-UHFFFAOYSA-N
XLogP4.73
TPSA92.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.40
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid with MolForge

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Related Compounds

2-[5,6-dimethoxy-2-(6-methoxynaphthalen-2-yl)-1-benzofuran-3-yl]acetic acid
CID 155486622
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CID 3597167
2-[2-(4-methoxyphenyl)-1H-indol-3-yl]acetic acid;piperidine
CID 159500765
2-[2-(2,4-dimethoxyphenyl)-1H-indol-3-yl]acetic acid
CID 5132997
6-methoxy-12,20-diazapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3(8),4,6,9,14,16,18-nonaen-21-one
CID 15360571
2-[2-(4-hydroxy-3-methoxycarbonylphenyl)-4-oxofuro[3,2-c]chromen-3-yl]acetic acid
CID 125428588
2-[2-(4-hydroxy-3-methoxyphenyl)-6-methyl-4-oxo-5H-furo[3,2-c]pyridin-3-yl]acetic acid
CID 127252915
ethyl 4-(4-hydroxy-3,5-dimethoxyphenyl)-2-imino-5-oxo-6H-pyrano[3,2-c]quinoline-3-carboxylate
CID 137316048
3-(hydroxymethyl)-6-methoxy-1H-quinolin-2-one
CID 865120
2-[2-(3-bromophenyl)-5-methoxy-1H-indol-3-yl]acetic acid
CID 4037576
2-(2-naphthalen-2-yl-1H-indol-3-yl)acetic acid;piperidine
CID 159486441
2-[5-hydroxy-3-(4-hydroxyphenyl)-8-(4-methoxyphenyl)-4-oxofuro[2,3-h]chromen-9-yl]acetic acid
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Frequently Asked Questions

What is the IUPAC name of 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid?
The IUPAC name of 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid (CID 146048783) is 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid.
What is the SMILES notation for 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid?
The canonical SMILES for 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid is COc1ccc2cc(-c3oc4c(c3CC(=O)O)c(=O)[nH]c3ccccc34)ccc2c1.
What is the InChIKey of 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid?
The InChIKey is LHYCTCLSSKUHGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NO5/c1-29-16-9-8-13-10-15(7-6-14(13)11-16)22-18(12-20(26)27)21-23(30-22)17-4-2-3-5-19(17)25-24(21)28/h2-11H,12H2,1H3,(H,25,28)(H,26,27).
What are the key properties of 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid?
2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid has a molecular weight of 399.40 g/mol, XLogP of 4.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(6-methoxynaphthalen-2-yl)-4-oxo-5H-furo[3,2-c]quinolin-3-yl]acetic acid is sourced from PubChem (CID 146048783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).