2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide

C17H18N4O2 — CID 71943051

IUPAC2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide
SMILESCc1cnc(C(=O)N2c3ccccc3C(C(N)=O)CC2C)cn1
InChIInChI=1S/C17H18N4O2/c1-10-8-20-14(9-19-10)17(23)21-11(2)7-13(16(18)22)12-5-3-4-6-15(12)21/h3-6,8-9,11,13H,7H2,1-2H3,(H2,18,22)
InChIKeyPFALTRQAJVUYOY-UHFFFAOYSA-N
MW310.36 g/mol
LogP1.79
Rot. Bonds2

About 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide

2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide (PubChem CID 71943051) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide.

Molecular Properties

Compound Name2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide
PubChem CID71943051
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide
SMILESCc1cnc(C(=O)N2c3ccccc3C(C(N)=O)CC2C)cn1
InChIInChI=1S/C17H18N4O2/c1-10-8-20-14(9-19-10)17(23)21-11(2)7-13(16(18)22)12-5-3-4-6-15(12)21/h3-6,8-9,11,13H,7H2,1-2H3,(H2,18,22)
InChIKeyPFALTRQAJVUYOY-UHFFFAOYSA-N
XLogP1.79
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,4S)-1-(2-tert-butyl-1,3-thiazole-5-carbonyl)-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 95190329
[(2S)-2-methyl-2,3-dihydroindol-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 93240954
(2R,4S)-1-[(1S,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 124856955
(2S,4R)-1-(2,4-dichloro-5-fluorobenzoyl)-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 51935821
(2R,4S)-2-methyl-1-(5-methyl-2-thiophen-2-yl-1,3-oxazole-4-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide
CID 97002457
1-(2-amino-2-oxoethyl)-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 167920926
(2S,4S)-2-methyl-1-(2-methylprop-2-enyl)-3,4-dihydro-2H-quinoline-4-carboxamide
CID 95584191
(2S,4S)-1-[2-(2-chlorophenyl)sulfanylacetyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 51935811
(2S,4R)-1-methoxycarbonyl-2-methyl-3,4-dihydro-2H-quinoline-4-carboxylic acid
CID 136585449
(2R,4R)-2-methyl-1-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]-3,4-dihydro-2H-quinoline-4-carboxamide
CID 100903784
(2S,4S)-1-[(E)-3-(3-chlorophenyl)prop-2-enoyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 51935791
(1,3-dimethyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)-(5-methylpyrazin-2-yl)methanone
CID 71860195

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide?
The IUPAC name of 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide (CID 71943051) is 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide.
What is the SMILES notation for 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide?
The canonical SMILES for 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide is Cc1cnc(C(=O)N2c3ccccc3C(C(N)=O)CC2C)cn1.
What is the InChIKey of 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide?
The InChIKey is PFALTRQAJVUYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-10-8-20-14(9-19-10)17(23)21-11(2)7-13(16(18)22)12-5-3-4-6-15(12)21/h3-6,8-9,11,13H,7H2,1-2H3,(H2,18,22).
What are the key properties of 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide?
2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide has a molecular weight of 310.36 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-2H-quinoline-4-carboxamide is sourced from PubChem (CID 71943051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).