4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide

C22H17N3O4 — CID 11211389

IUPAC4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide
SMILESCOc1cc2nccc(Oc3ccc4c(C(N)=O)cccc4c3)c2cc1C(N)=O
InChIInChI=1S/C22H17N3O4/c1-28-20-11-18-16(10-17(20)22(24)27)19(7-8-25-18)29-13-5-6-14-12(9-13)3-2-4-15(14)21(23)26/h2-11H,1H3,(H2,23,26)(H2,24,27)
InChIKeyHSAQBRJGYZIVJP-UHFFFAOYSA-N
MW387.40 g/mol
LogP3.39
Rot. Bonds5

About 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide

4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide (PubChem CID 11211389) has the molecular formula C22H17N3O4 and a molecular weight of 387.40 g/mol. Its IUPAC name is 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide.

Molecular Properties

Compound Name4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide
PubChem CID11211389
Molecular FormulaC22H17N3O4
Molecular Weight387.40 g/mol
Exact Mass387.12
IUPAC Name4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide
SMILESCOc1cc2nccc(Oc3ccc4c(C(N)=O)cccc4c3)c2cc1C(N)=O
InChIInChI=1S/C22H17N3O4/c1-28-20-11-18-16(10-17(20)22(24)27)19(7-8-25-18)29-13-5-6-14-12(9-13)3-2-4-15(14)21(23)26/h2-11H,1H3,(H2,23,26)(H2,24,27)
InChIKeyHSAQBRJGYZIVJP-UHFFFAOYSA-N
XLogP3.39
TPSA117.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.40
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide?
The IUPAC name of 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide (CID 11211389) is 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide.
What is the SMILES notation for 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide?
The canonical SMILES for 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide is COc1cc2nccc(Oc3ccc4c(C(N)=O)cccc4c3)c2cc1C(N)=O.
What is the InChIKey of 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide?
The InChIKey is HSAQBRJGYZIVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O4/c1-28-20-11-18-16(10-17(20)22(24)27)19(7-8-25-18)29-13-5-6-14-12(9-13)3-2-4-15(14)21(23)26/h2-11H,1H3,(H2,23,26)(H2,24,27).
What are the key properties of 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide?
4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide has a molecular weight of 387.40 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-carbamoylnaphthalen-2-yl)oxy-7-methoxyquinoline-6-carboxamide is sourced from PubChem (CID 11211389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).