4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide

C15H18N4O3 — CID 134797187

IUPAC4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
SMILESCOCCCNC(=O)c1nc2cccnc2n(C2CC2)c1=O
InChIInChI=1S/C15H18N4O3/c1-22-9-3-8-17-14(20)12-15(21)19(10-5-6-10)13-11(18-12)4-2-7-16-13/h2,4,7,10H,3,5-6,8-9H2,1H3,(H,17,20)
InChIKeyWGOIZKAFSLKSAG-UHFFFAOYSA-N
MW302.33 g/mol
LogP0.89
Rot. Bonds6

About 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide

4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide (PubChem CID 134797187) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
PubChem CID134797187
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC Name4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
SMILESCOCCCNC(=O)c1nc2cccnc2n(C2CC2)c1=O
InChIInChI=1S/C15H18N4O3/c1-22-9-3-8-17-14(20)12-15(21)19(10-5-6-10)13-11(18-12)4-2-7-16-13/h2,4,7,10H,3,5-6,8-9H2,1H3,(H,17,20)
InChIKeyWGOIZKAFSLKSAG-UHFFFAOYSA-N
XLogP0.89
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
The IUPAC name of 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide (CID 134797187) is 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide is COCCCNC(=O)c1nc2cccnc2n(C2CC2)c1=O.
What is the InChIKey of 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
The InChIKey is WGOIZKAFSLKSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-22-9-3-8-17-14(20)12-15(21)19(10-5-6-10)13-11(18-12)4-2-7-16-13/h2,4,7,10H,3,5-6,8-9H2,1H3,(H,17,20).
What are the key properties of 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide?
4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 0.89, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide is sourced from PubChem (CID 134797187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).