7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide

C24H25N5O3 — CID 162753983

IUPAC7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide
SMILESCNC(=O)c1cc2c(cc1C#N)N(c1cc(OC)cc3c1cc(C)c(=O)n3C)CCN2C
InChIInChI=1S/C24H25N5O3/c1-14-8-18-19(28(4)24(14)31)10-16(32-5)11-20(18)29-7-6-27(3)21-12-17(23(30)26-2)15(13-25)9-22(21)29/h8-12H,6-7H2,1-5H3,(H,26,30)
InChIKeyRLSGYTFBKSJLSU-UHFFFAOYSA-N
MW431.50 g/mol
LogP2.67
Rot. Bonds3

About 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide

7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide (PubChem CID 162753983) has the molecular formula C24H25N5O3 and a molecular weight of 431.50 g/mol. Its IUPAC name is 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide.

Molecular Properties

Compound Name7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide
PubChem CID162753983
Molecular FormulaC24H25N5O3
Molecular Weight431.50 g/mol
Exact Mass431.20
IUPAC Name7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide
SMILESCNC(=O)c1cc2c(cc1C#N)N(c1cc(OC)cc3c1cc(C)c(=O)n3C)CCN2C
InChIInChI=1S/C24H25N5O3/c1-14-8-18-19(28(4)24(14)31)10-16(32-5)11-20(18)29-7-6-27(3)21-12-17(23(30)26-2)15(13-25)9-22(21)29/h8-12H,6-7H2,1-5H3,(H,26,30)
InChIKeyRLSGYTFBKSJLSU-UHFFFAOYSA-N
XLogP2.67
TPSA90.60 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

1-[7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-4-methyl-2,3-dihydroquinoxalin-6-yl]piperidine-4-carboxylic acid
CID 162753953
4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-1-methyl-7-phenyl-2,3-dihydroquinoxaline-6-carbonitrile
CID 170288703
4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-1-methyl-7-(1H-pyrazol-4-yl)-2,3-dihydroquinoxaline-6-carbonitrile
CID 177223817
4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-1-methyl-7-(2-oxo-1H-pyrimidin-5-yl)-2,3-dihydroquinoxaline-6-carbonitrile
CID 162753730
7-(1-iodo-3,6-dihydro-2H-pyridin-4-yl)-4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-1-methyl-2,3-dihydroquinoxaline-6-carbonitrile
CID 167009109
7-(4-acetylpiperazin-1-yl)-1-ethyl-4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-2,3-dihydroquinoxaline-6-carbonitrile
CID 162753985
4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-2,3-dihydro-1H-quinoxaline-6-carbonitrile
CID 176949277
N-[1-[4-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-1-methyl-2,3-dihydropyrido[3,4-b]pyrazin-7-yl]piperidin-3-yl]acetamide
CID 162754006
7-methoxy-1,3-dimethyl-5-[1-methyl-7-(2-oxopiperidin-1-yl)-2,3-dihydropyrido[3,4-b]pyrazin-4-yl]quinolin-2-one
CID 162753615
4-[1,3-dimethyl-7-[(1-methylpiperidin-3-yl)methoxy]-2-oxoquinolin-5-yl]-1-methyl-7-(1H-pyrazol-4-yl)-2,3-dihydroquinoxaline-6-carbonitrile
CID 178139254
4-[1,3-dimethyl-2-oxo-7-(2-piperidin-4-ylethoxy)quinolin-5-yl]-1-methyl-7-(1-methylpyrazol-4-yl)-2,3-dihydroquinoxaline-6-carbonitrile
CID 176986611
4-(1,3-dimethyl-2-oxo-1,7-naphthyridin-5-yl)-1-methyl-7-(1-methylpyrazol-4-yl)-2,3-dihydroquinoxaline-6-carbonitrile
CID 162753645

Frequently Asked Questions

What is the IUPAC name of 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide?
The IUPAC name of 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide (CID 162753983) is 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide.
What is the SMILES notation for 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide?
The canonical SMILES for 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide is CNC(=O)c1cc2c(cc1C#N)N(c1cc(OC)cc3c1cc(C)c(=O)n3C)CCN2C.
What is the InChIKey of 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide?
The InChIKey is RLSGYTFBKSJLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O3/c1-14-8-18-19(28(4)24(14)31)10-16(32-5)11-20(18)29-7-6-27(3)21-12-17(23(30)26-2)15(13-25)9-22(21)29/h8-12H,6-7H2,1-5H3,(H,26,30).
What are the key properties of 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide?
7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide has a molecular weight of 431.50 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyano-1-(7-methoxy-1,3-dimethyl-2-oxoquinolin-5-yl)-N,4-dimethyl-2,3-dihydroquinoxaline-6-carboxamide is sourced from PubChem (CID 162753983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).