N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide

C20H19N3O3 — CID 17410272

IUPACN-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide
SMILESCCNC(=O)c1cccc(NC(=O)c2ccc3cc(OC)ccc3n2)c1
InChIInChI=1S/C20H19N3O3/c1-3-21-19(24)14-5-4-6-15(11-14)22-20(25)18-9-7-13-12-16(26-2)8-10-17(13)23-18/h4-12H,3H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyYGMSBYBOPNMUQX-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.25
Rot. Bonds5

About N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide

N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide (PubChem CID 17410272) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide.

Molecular Properties

Compound NameN-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide
PubChem CID17410272
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide
SMILESCCNC(=O)c1cccc(NC(=O)c2ccc3cc(OC)ccc3n2)c1
InChIInChI=1S/C20H19N3O3/c1-3-21-19(24)14-5-4-6-15(11-14)22-20(25)18-9-7-13-12-16(26-2)8-10-17(13)23-18/h4-12H,3H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyYGMSBYBOPNMUQX-UHFFFAOYSA-N
XLogP3.25
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-6-methoxyquinoline-2-carboxamide
CID 18131971
N-(4-ethoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33314007
N-ethyl-3-[[2-(4-methoxyphenyl)acetyl]amino]benzamide
CID 17230663
6-methoxy-N-[2-methyl-5-(phenylcarbamoyl)phenyl]quinoline-2-carboxamide
CID 78887491
N-[3-(ethylcarbamoyl)phenyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 17473266
N-[3-(ethylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 17439182
N-(1,3-benzodioxol-5-yl)-6-methoxyquinoline-2-carboxamide
CID 33313694
3-[[2-(2-chloro-5-methoxyanilino)acetyl]amino]-N-ethylbenzamide
CID 47079023
3,5-dichloro-N-[3-(ethylcarbamoyl)phenyl]-4-methoxybenzamide
CID 51217682
3-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)acetyl]amino]-N-ethylbenzamide
CID 17427292
N-ethyl-3-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
CID 17230651
N-[4-(cyclopropanecarbonylamino)phenyl]-6-methoxyquinoline-2-carboxamide
CID 24601678

Frequently Asked Questions

What is the IUPAC name of N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide?
The IUPAC name of N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide (CID 17410272) is N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide.
What is the SMILES notation for N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide?
The canonical SMILES for N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide is CCNC(=O)c1cccc(NC(=O)c2ccc3cc(OC)ccc3n2)c1.
What is the InChIKey of N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide?
The InChIKey is YGMSBYBOPNMUQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-3-21-19(24)14-5-4-6-15(11-14)22-20(25)18-9-7-13-12-16(26-2)8-10-17(13)23-18/h4-12H,3H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide?
N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(ethylcarbamoyl)phenyl]-6-methoxyquinoline-2-carboxamide is sourced from PubChem (CID 17410272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).