4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide

C26H23N3O4 — CID 11316645

IUPAC4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide
SMILESCNC(=O)c1cc2c(Oc3ccc4c(C(=O)NC5CC5)cccc4c3)ccnc2cc1OC
InChIInChI=1S/C26H23N3O4/c1-27-25(30)21-13-20-22(14-24(21)32-2)28-11-10-23(20)33-17-8-9-18-15(12-17)4-3-5-19(18)26(31)29-16-6-7-16/h3-5,8-14,16H,6-7H2,1-2H3,(H,27,30)(H,29,31)
InChIKeyGBPURKNOSRMCPP-UHFFFAOYSA-N
MW441.49 g/mol
LogP4.44
Rot. Bonds6

About 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide

4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide (PubChem CID 11316645) has the molecular formula C26H23N3O4 and a molecular weight of 441.49 g/mol. Its IUPAC name is 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide.

Molecular Properties

Compound Name4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide
PubChem CID11316645
Molecular FormulaC26H23N3O4
Molecular Weight441.49 g/mol
Exact Mass441.17
IUPAC Name4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide
SMILESCNC(=O)c1cc2c(Oc3ccc4c(C(=O)NC5CC5)cccc4c3)ccnc2cc1OC
InChIInChI=1S/C26H23N3O4/c1-27-25(30)21-13-20-22(14-24(21)32-2)28-11-10-23(20)33-17-8-9-18-15(12-17)4-3-5-19(18)26(31)29-16-6-7-16/h3-5,8-14,16H,6-7H2,1-2H3,(H,27,30)(H,29,31)
InChIKeyGBPURKNOSRMCPP-UHFFFAOYSA-N
XLogP4.44
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.49
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-(cyclopropylcarbamoylamino)phenoxy]-7-methoxy-N-methylquinoline-6-carboxamide
CID 58931475
6-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxy-N-methylnaphthalene-1-carboxamide
CID 67276786
7-methoxy-4-(3-methoxyphenoxy)-N-methylquinoline-6-carboxamide
CID 69131598
6-[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]oxy-N-methylnaphthalene-1-carboxamide
CID 25031916
6-[7-[[1-(hydroxymethyl)cyclopropyl]amino]-6-methoxyquinolin-4-yl]oxy-N-methylnaphthalene-1-carboxamide
CID 155077042
6-(6,7-dimethoxyquinolin-4-yl)oxy-N-propan-2-ylnaphthalene-1-carboxamide
CID 24822600
N-cyclopropyl-2-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-1-carboxamide;7-methoxy-4-[5-(2-methoxyethylcarbamoyl)naphthalen-2-yl]oxyquinoline-6-carboxamide
CID 69446942
4-[4-(cyclopropylcarbamoylamino)-3-(iodomethyl)phenoxy]-7-methoxy-N-methylquinoline-6-carboxamide
CID 89337940
4-[5-[(3,4-dimethylphenyl)carbamoyl]naphthalen-2-yl]oxy-7-methoxyquinoline-6-carboxamide
CID 175933294
6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-1-carboxamide
CID 11474276
4-[5-[(4-chlorophenyl)carbamoyl]naphthalen-2-yl]oxy-7-methoxyquinoline-6-carboxamide
CID 24822268
6-(6,7-dimethoxyquinolin-4-yl)oxy-N-[[(2S)-oxolan-2-yl]methyl]naphthalene-1-carboxamide
CID 59813247

Frequently Asked Questions

What is the IUPAC name of 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide?
The IUPAC name of 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide (CID 11316645) is 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide.
What is the SMILES notation for 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide?
The canonical SMILES for 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide is CNC(=O)c1cc2c(Oc3ccc4c(C(=O)NC5CC5)cccc4c3)ccnc2cc1OC.
What is the InChIKey of 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide?
The InChIKey is GBPURKNOSRMCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O4/c1-27-25(30)21-13-20-22(14-24(21)32-2)28-11-10-23(20)33-17-8-9-18-15(12-17)4-3-5-19(18)26(31)29-16-6-7-16/h3-5,8-14,16H,6-7H2,1-2H3,(H,27,30)(H,29,31).
What are the key properties of 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide?
4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide has a molecular weight of 441.49 g/mol, XLogP of 4.44, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(cyclopropylcarbamoyl)naphthalen-2-yl]oxy-7-methoxy-N-methylquinoline-6-carboxamide is sourced from PubChem (CID 11316645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).