N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide

C16H26N4O — CID 118032751

IUPACN-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide
SMILESCC(=O)NCC1Cc2ncc(C(C)C)nc2N(C(C)C)C1
InChIInChI=1S/C16H26N4O/c1-10(2)15-8-18-14-6-13(7-17-12(5)21)9-20(11(3)4)16(14)19-15/h8,10-11,13H,6-7,9H2,1-5H3,(H,17,21)
InChIKeyUYKXZVXYIQBIAU-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.12
Rot. Bonds4

About N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide

N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide (PubChem CID 118032751) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide
PubChem CID118032751
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide
SMILESCC(=O)NCC1Cc2ncc(C(C)C)nc2N(C(C)C)C1
InChIInChI=1S/C16H26N4O/c1-10(2)15-8-18-14-6-13(7-17-12(5)21)9-20(11(3)4)16(14)19-15/h8,10-11,13H,6-7,9H2,1-5H3,(H,17,21)
InChIKeyUYKXZVXYIQBIAU-UHFFFAOYSA-N
XLogP2.12
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide?
The IUPAC name of N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide (CID 118032751) is N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide.
What is the SMILES notation for N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide?
The canonical SMILES for N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide is CC(=O)NCC1Cc2ncc(C(C)C)nc2N(C(C)C)C1.
What is the InChIKey of N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide?
The InChIKey is UYKXZVXYIQBIAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-10(2)15-8-18-14-6-13(7-17-12(5)21)9-20(11(3)4)16(14)19-15/h8,10-11,13H,6-7,9H2,1-5H3,(H,17,21).
What are the key properties of N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide?
N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide has a molecular weight of 290.41 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3,5-di(propan-2-yl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-7-yl]methyl]acetamide is sourced from PubChem (CID 118032751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).