2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide

C10H13N3O2 — CID 80637307

IUPAC2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide
SMILESCNC(=O)CN(C)c1ccc(C=O)cn1
InChIInChI=1S/C10H13N3O2/c1-11-10(15)6-13(2)9-4-3-8(7-14)5-12-9/h3-5,7H,6H2,1-2H3,(H,11,15)
InChIKeyIZJCOUOHDSNEOS-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.08
Rot. Bonds4

About 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide

2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide (PubChem CID 80637307) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide
PubChem CID80637307
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide
SMILESCNC(=O)CN(C)c1ccc(C=O)cn1
InChIInChI=1S/C10H13N3O2/c1-11-10(15)6-13(2)9-4-3-8(7-14)5-12-9/h3-5,7H,6H2,1-2H3,(H,11,15)
InChIKeyIZJCOUOHDSNEOS-UHFFFAOYSA-N
XLogP0.08
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-formyl-2-pyridinyl)-methylamino]acetamide
CID 80637138
2-[(5-formyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80638047
N-methyl-2-[methyl-[5-(propylaminomethyl)-2-pyridinyl]amino]acetamide
CID 80630091
6-[ethyl(methyl)amino]pyridine-3-carbaldehyde
CID 76848692
N-methyl-2-[methyl-[5-[(2-methylpropylamino)methyl]-2-pyridinyl]amino]acetamide
CID 80630475
methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate
CID 103772153
6-chloropyridine-3-carbaldehyde;6-[2-hydroxyethyl(methyl)amino]pyridine-3-carbaldehyde;2-(methylamino)ethanol
CID 164948661
2-[(2-aminopyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 80779602
2-[[6-(aminomethyl)-3-pyridinyl]-methylamino]-N-methylacetamide
CID 115486849
2-[(2-chloropyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 62342254
2-[(5-chloro-2-pyridinyl)-methylamino]-N-(2-hydroxy-2-methylbutyl)acetamide
CID 65114648
2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]-N-propan-2-ylacetamide
CID 80630228

Frequently Asked Questions

What is the IUPAC name of 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide?
The IUPAC name of 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide (CID 80637307) is 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide?
The canonical SMILES for 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide is CNC(=O)CN(C)c1ccc(C=O)cn1.
What is the InChIKey of 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide?
The InChIKey is IZJCOUOHDSNEOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-11-10(15)6-13(2)9-4-3-8(7-14)5-12-9/h3-5,7H,6H2,1-2H3,(H,11,15).
What are the key properties of 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide?
2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide has a molecular weight of 207.23 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide is sourced from PubChem (CID 80637307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).