4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide

C14H18N4O3 — CID 134800007

IUPAC4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide
SMILESCOCCn1c(=O)c(C(=O)NC(C)C)nc2cccnc21
InChIInChI=1S/C14H18N4O3/c1-9(2)16-13(19)11-14(20)18(7-8-21-3)12-10(17-11)5-4-6-15-12/h4-6,9H,7-8H2,1-3H3,(H,16,19)
InChIKeyKFUMNSCMQSPEON-UHFFFAOYSA-N
MW290.32 g/mol
LogP0.58
Rot. Bonds5

About 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide

4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide (PubChem CID 134800007) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide.

Molecular Properties

Compound Name4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide
PubChem CID134800007
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide
SMILESCOCCn1c(=O)c(C(=O)NC(C)C)nc2cccnc21
InChIInChI=1S/C14H18N4O3/c1-9(2)16-13(19)11-14(20)18(7-8-21-3)12-10(17-11)5-4-6-15-12/h4-6,9H,7-8H2,1-3H3,(H,16,19)
InChIKeyKFUMNSCMQSPEON-UHFFFAOYSA-N
XLogP0.58
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide?
The IUPAC name of 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide (CID 134800007) is 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide.
What is the SMILES notation for 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide?
The canonical SMILES for 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide is COCCn1c(=O)c(C(=O)NC(C)C)nc2cccnc21.
What is the InChIKey of 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide?
The InChIKey is KFUMNSCMQSPEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-9(2)16-13(19)11-14(20)18(7-8-21-3)12-10(17-11)5-4-6-15-12/h4-6,9H,7-8H2,1-3H3,(H,16,19).
What are the key properties of 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide?
4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 0.58, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide is sourced from PubChem (CID 134800007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).