4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide

C17H22N4O2 — CID 134800302

IUPAC4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
SMILESCCCCn1c(=O)c(C(=O)NC2CCCC2)nc2cccnc21
InChIInChI=1S/C17H22N4O2/c1-2-3-11-21-15-13(9-6-10-18-15)20-14(17(21)23)16(22)19-12-7-4-5-8-12/h6,9-10,12H,2-5,7-8,11H2,1H3,(H,19,22)
InChIKeyXRAYOHXFLRRCCM-UHFFFAOYSA-N
MW314.39 g/mol
LogP2.26
Rot. Bonds5

About 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide

4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide (PubChem CID 134800302) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide.

Molecular Properties

Compound Name4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
PubChem CID134800302
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
SMILESCCCCn1c(=O)c(C(=O)NC2CCCC2)nc2cccnc21
InChIInChI=1S/C17H22N4O2/c1-2-3-11-21-15-13(9-6-10-18-15)20-14(17(21)23)16(22)19-12-7-4-5-8-12/h6,9-10,12H,2-5,7-8,11H2,1H3,(H,19,22)
InChIKeyXRAYOHXFLRRCCM-UHFFFAOYSA-N
XLogP2.26
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclopropylmethyl)-4-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 134798713
1-(4-butyl-3-oxopyrido[2,3-b]pyrazine-2-carbonyl)piperidine-4-carbonitrile
CID 134797682
N-(1-benzylpiperidin-4-yl)-4-(2-methylpropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 53189852
2-[4-(cyclopentanecarbonyl)piperazine-1-carbonyl]-4-(3-methoxypropyl)pyrido[2,3-b]pyrazin-3-one
CID 134800423
N-cyclopentyl-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619782
4-(2-methylpropyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide
CID 53189854
N-cyclohexyl-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393860
4-(3-methoxypropyl)-2-(4-phenylpiperidine-1-carbonyl)pyrido[2,3-b]pyrazin-3-one
CID 134799498
4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 134797187
N-cyclopentyl-3-[3-(2-methoxyethyl)imidazo[4,5-b]pyridin-2-yl]propanamide
CID 126456884
N-(3-methoxypropyl)-4-methyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 53189744
N-cyclooctyl-1-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperidine-3-carboxamide
CID 46324894

Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
The IUPAC name of 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide (CID 134800302) is 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide.
What is the SMILES notation for 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
The canonical SMILES for 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide is CCCCn1c(=O)c(C(=O)NC2CCCC2)nc2cccnc21.
What is the InChIKey of 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
The InChIKey is XRAYOHXFLRRCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-2-3-11-21-15-13(9-6-10-18-15)20-14(17(21)23)16(22)19-12-7-4-5-8-12/h6,9-10,12H,2-5,7-8,11H2,1H3,(H,19,22).
What are the key properties of 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide has a molecular weight of 314.39 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-cyclopentyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide is sourced from PubChem (CID 134800302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).