4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide

C25H24N4O2 — CID 92884755

IUPAC4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide
SMILESCCCn1c(=O)c(-c2ccc(C(=O)N[C@H](C)c3ccccc3)cc2)nc2cccnc21
InChIInChI=1S/C25H24N4O2/c1-3-16-29-23-21(10-7-15-26-23)28-22(25(29)31)19-11-13-20(14-12-19)24(30)27-17(2)18-8-5-4-6-9-18/h4-15,17H,3,16H2,1-2H3,(H,27,30)/t17-/m1/s1
InChIKeyHXQSJDSUNVEUHP-QGZVFWFLSA-N
MW412.49 g/mol
LogP4.36
Rot. Bonds6

About 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide

4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide (PubChem CID 92884755) has the molecular formula C25H24N4O2 and a molecular weight of 412.49 g/mol. Its IUPAC name is 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide
PubChem CID92884755
Molecular FormulaC25H24N4O2
Molecular Weight412.49 g/mol
Exact Mass412.19
IUPAC Name4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide
SMILESCCCn1c(=O)c(-c2ccc(C(=O)N[C@H](C)c3ccccc3)cc2)nc2cccnc21
InChIInChI=1S/C25H24N4O2/c1-3-16-29-23-21(10-7-15-26-23)28-22(25(29)31)19-11-13-20(14-12-19)24(30)27-17(2)18-8-5-4-6-9-18/h4-15,17H,3,16H2,1-2H3,(H,27,30)/t17-/m1/s1
InChIKeyHXQSJDSUNVEUHP-QGZVFWFLSA-N
XLogP4.36
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 46393908
N-[(1R)-1-phenylethyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)benzamide
CID 95097061
4-(3-oxo-4-propylquinoxalin-2-yl)-N-phenylbenzamide
CID 50838506
N-(2-ethylphenyl)-4-(3-oxo-4-propan-2-ylpyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393780
N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393883
4-[[3-[(3-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]-N-(1-phenylethyl)benzamide
CID 20908340
N-[(2R)-butan-2-yl]-4-[4-(2-methylpropyl)-3-oxoquinoxalin-2-yl]benzamide
CID 92898885
N-(4-acetamidophenyl)-4-(3-oxo-4-propylquinoxalin-2-yl)benzamide
CID 50838498
4-(4-methyl-3-oxoquinoxalin-2-yl)-N-propan-2-ylbenzamide
CID 46395275
1-methyl-2-oxo-N-[(1S)-1-phenylethyl]-1,8-naphthyridine-3-carboxamide
CID 7619432
N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393769
N-[(2-chlorophenyl)methyl]-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393814

Frequently Asked Questions

What is the IUPAC name of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide?
The IUPAC name of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide (CID 92884755) is 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide.
What is the SMILES notation for 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide?
The canonical SMILES for 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide is CCCn1c(=O)c(-c2ccc(C(=O)N[C@H](C)c3ccccc3)cc2)nc2cccnc21.
What is the InChIKey of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide?
The InChIKey is HXQSJDSUNVEUHP-QGZVFWFLSA-N. The full InChI is InChI=1S/C25H24N4O2/c1-3-16-29-23-21(10-7-15-26-23)28-22(25(29)31)19-11-13-20(14-12-19)24(30)27-17(2)18-8-5-4-6-9-18/h4-15,17H,3,16H2,1-2H3,(H,27,30)/t17-/m1/s1.
What are the key properties of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide?
4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide has a molecular weight of 412.49 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide is sourced from PubChem (CID 92884755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).