4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide

C23H21N5O2 — CID 46393908

IUPAC4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide
SMILESCCCn1c(=O)c(-c2ccc(C(=O)NCc3ccccn3)cc2)nc2cccnc21
InChIInChI=1S/C23H21N5O2/c1-2-14-28-21-19(7-5-13-25-21)27-20(23(28)30)16-8-10-17(11-9-16)22(29)26-15-18-6-3-4-12-24-18/h3-13H,2,14-15H2,1H3,(H,26,29)
InChIKeyLPHDBGLNSUOTTQ-UHFFFAOYSA-N
MW399.45 g/mol
LogP3.19
Rot. Bonds6

About 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide

4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 46393908) has the molecular formula C23H21N5O2 and a molecular weight of 399.45 g/mol. Its IUPAC name is 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide
PubChem CID46393908
Molecular FormulaC23H21N5O2
Molecular Weight399.45 g/mol
Exact Mass399.17
IUPAC Name4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide
SMILESCCCn1c(=O)c(-c2ccc(C(=O)NCc3ccccn3)cc2)nc2cccnc21
InChIInChI=1S/C23H21N5O2/c1-2-14-28-21-19(7-5-13-25-21)27-20(23(28)30)16-8-10-17(11-9-16)22(29)26-15-18-6-3-4-12-24-18/h3-13H,2,14-15H2,1H3,(H,26,29)
InChIKeyLPHDBGLNSUOTTQ-UHFFFAOYSA-N
XLogP3.19
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyethyl)-4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393924
4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide
CID 92884755
N-[(2-chlorophenyl)methyl]-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393814
4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 20916068
N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393769
N-[(2,5-dimethoxyphenyl)methyl]-4-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393771
4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 46393856
N-[(3,4-dimethoxyphenyl)methyl]-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393870
2,3-dipropyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
CID 152760188
4-(3-oxo-4-propylquinoxalin-2-yl)-N-phenylbenzamide
CID 50838506
2-(3-oxo-2-phenylpyrido[2,3-b]pyrazin-4-yl)acetic acid
CID 134154466
N-(3-ethoxypropyl)-4-(3-oxo-4-propylquinoxalin-2-yl)benzamide
CID 50838486

Frequently Asked Questions

What is the IUPAC name of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide (CID 46393908) is 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide is CCCn1c(=O)c(-c2ccc(C(=O)NCc3ccccn3)cc2)nc2cccnc21.
What is the InChIKey of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is LPHDBGLNSUOTTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O2/c1-2-14-28-21-19(7-5-13-25-21)27-20(23(28)30)16-8-10-17(11-9-16)22(29)26-15-18-6-3-4-12-24-18/h3-13H,2,14-15H2,1H3,(H,26,29).
What are the key properties of 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide?
4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 399.45 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 46393908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).