N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide

C23H26N4O2 — CID 46393883

IUPACN-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
SMILESCCC(C)NC(=O)c1ccc(-c2nc3cccnc3n(C3CCCC3)c2=O)cc1
InChIInChI=1S/C23H26N4O2/c1-3-15(2)25-22(28)17-12-10-16(11-13-17)20-23(29)27(18-7-4-5-8-18)21-19(26-20)9-6-14-24-21/h6,9-15,18H,3-5,7-8H2,1-2H3,(H,25,28)
InChIKeyYMDNKROHFVDXRP-UHFFFAOYSA-N
MW390.49 g/mol
LogP4.10
Rot. Bonds5

About N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide

N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide (PubChem CID 46393883) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide.

Molecular Properties

Compound NameN-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
PubChem CID46393883
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
SMILESCCC(C)NC(=O)c1ccc(-c2nc3cccnc3n(C3CCCC3)c2=O)cc1
InChIInChI=1S/C23H26N4O2/c1-3-15(2)25-22(28)17-12-10-16(11-13-17)20-23(29)27(18-7-4-5-8-18)21-19(26-20)9-6-14-24-21/h6,9-15,18H,3-5,7-8H2,1-2H3,(H,25,28)
InChIKeyYMDNKROHFVDXRP-UHFFFAOYSA-N
XLogP4.10
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393860
N-[(2R)-butan-2-yl]-4-[4-(2-methylpropyl)-3-oxoquinoxalin-2-yl]benzamide
CID 92898885
4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-[(1R)-1-phenylethyl]benzamide
CID 92884755
N-butan-2-yl-4-methyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 53016720
2-amino-N-butan-2-yl-1-cyclohexylpyrrolo[3,2-b]quinoxaline-3-carboxamide
CID 3742039
N-(2-ethylphenyl)-4-(3-oxo-4-propan-2-ylpyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393780
N-butan-2-yl-4-[2-(trifluoromethyl)imidazo[4,5-b]pyridin-3-yl]piperidine-1-carboxamide
CID 46286636
N-(2-methoxyethyl)-4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393924
1-[(2S)-butan-2-yl]-3-[1-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperidin-4-yl]urea
CID 95053319
N-(3,5-dimethylphenyl)-4-(3-oxo-4-propan-2-ylpyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393790
4-(4-methyl-3-oxoquinoxalin-2-yl)-N-propan-2-ylbenzamide
CID 46395275
4-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)-N-[(3-methoxyphenyl)methyl]benzamide
CID 50847066

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide?
The IUPAC name of N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide (CID 46393883) is N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide.
What is the SMILES notation for N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide?
The canonical SMILES for N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide is CCC(C)NC(=O)c1ccc(-c2nc3cccnc3n(C3CCCC3)c2=O)cc1.
What is the InChIKey of N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide?
The InChIKey is YMDNKROHFVDXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-3-15(2)25-22(28)17-12-10-16(11-13-17)20-23(29)27(18-7-4-5-8-18)21-19(26-20)9-6-14-24-21/h6,9-15,18H,3-5,7-8H2,1-2H3,(H,25,28).
What are the key properties of N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide?
N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide has a molecular weight of 390.49 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-4-(4-cyclopentyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide is sourced from PubChem (CID 46393883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).