2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde

C10H13N3O — CID 83847150

IUPAC2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde
SMILESCN1CCN(CC=O)c2ncccc21
InChIInChI=1S/C10H13N3O/c1-12-5-6-13(7-8-14)10-9(12)3-2-4-11-10/h2-4,8H,5-7H2,1H3
InChIKeyBDXWXWCEOQOWFW-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.54
Rot. Bonds2

About 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde

2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde (PubChem CID 83847150) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde.

Molecular Properties

Compound Name2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde
PubChem CID83847150
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde
SMILESCN1CCN(CC=O)c2ncccc21
InChIInChI=1S/C10H13N3O/c1-12-5-6-13(7-8-14)10-9(12)3-2-4-11-10/h2-4,8H,5-7H2,1H3
InChIKeyBDXWXWCEOQOWFW-UHFFFAOYSA-N
XLogP0.54
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-4-methyl-2,3-dihydropyrido[2,3-b]pyrazine
CID 127763309
2-(7,8-difluoro-4-methyl-2,3-dihydroquinoxalin-1-yl)acetaldehyde
CID 83850057
2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde
CID 57135184
2-cyclopentyl-1-(4-prop-2-enyl-2,3-dihydropyrido[2,3-b]pyrazin-1-yl)ethanone
CID 53033960
2-(6-methoxy-4-methyl-2,3-dihydroquinoxalin-1-yl)acetaldehyde
CID 83849536
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridin-3-amine
CID 63778740
N-(2-ethylphenyl)-4-prop-2-enyl-2,3-dihydropyrido[2,3-b]pyrazine-1-carboxamide
CID 53071803
2-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]pyridin-3-amine
CID 104740104
ethyl 5-(4-methyl-2,3-dihydropyrido[2,3-b]pyrazin-1-yl)pentanoate
CID 75393904
N-(3,4-dimethylphenyl)-4-prop-2-enyl-2,3-dihydropyrido[2,3-b]pyrazine-1-carboxamide
CID 53071783
N-(2,3-dimethylphenyl)-4-prop-2-enyl-2,3-dihydropyrido[2,3-b]pyrazine-1-carboxamide
CID 53071781
1-methyl-2,3-dihydro-1,5-naphthyridin-4-one
CID 20822917

Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde?
The IUPAC name of 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde (CID 83847150) is 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde.
What is the SMILES notation for 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde?
The canonical SMILES for 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde is CN1CCN(CC=O)c2ncccc21.
What is the InChIKey of 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde?
The InChIKey is BDXWXWCEOQOWFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-12-5-6-13(7-8-14)10-9(12)3-2-4-11-10/h2-4,8H,5-7H2,1H3.
What are the key properties of 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde?
2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde has a molecular weight of 191.23 g/mol, XLogP of 0.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2,3-dihydropyrido[2,3-b]pyrazin-4-yl)acetaldehyde is sourced from PubChem (CID 83847150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).