2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde

C8H10N2O — CID 87928859

IUPAC2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde
SMILESCc1cc(C(N)C=O)ccn1
InChIInChI=1S/C8H10N2O/c1-6-4-7(2-3-10-6)8(9)5-11/h2-5,8H,9H2,1H3
InChIKeyGOUWUDGEHCDKMK-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.59
Rot. Bonds2

About 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde

2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde (PubChem CID 87928859) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde.

Molecular Properties

Compound Name2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde
PubChem CID87928859
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde
SMILESCc1cc(C(N)C=O)ccn1
InChIInChI=1S/C8H10N2O/c1-6-4-7(2-3-10-6)8(9)5-11/h2-5,8H,9H2,1H3
InChIKeyGOUWUDGEHCDKMK-UHFFFAOYSA-N
XLogP0.59
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methyl-4-pyridinyl)propan-1-amine
CID 55295377
(1S,2S)-1-amino-1-(2-methyl-4-pyridinyl)propan-2-ol
CID 55295314
(1S,2R)-2-amino-1-(2-methyl-4-pyridinyl)propan-1-ol
CID 96740451
2-amino-2-(2-methyl-4-pyridinyl)ethanol
CID 55292030
(2S)-2-amino-2-(2-methyl-4-pyridinyl)ethanol
CID 55264047
1-(2-methyl-4-pyridinyl)ethanol
CID 106756390
4-[bromo(nitro)methyl]-2-methylpyridine
CID 119090074
(ethenylideneamino)-(2-methyl-4-pyridinyl)methanamine
CID 143759959
(2-methyl-4-pyridinyl)-(4-phenylphenyl)methanamine
CID 106755381
(2-methyl-4-pyridinyl)-(5-methylthiophen-2-yl)methanamine
CID 106755531
3-amino-1-(2-methyl-4-pyridinyl)propane-1,2-diol
CID 170827559
1-(2-methyl-4-pyridinyl)hex-5-yn-1-amine
CID 106755808

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde?
The IUPAC name of 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde (CID 87928859) is 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde.
What is the SMILES notation for 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde?
The canonical SMILES for 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde is Cc1cc(C(N)C=O)ccn1.
What is the InChIKey of 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde?
The InChIKey is GOUWUDGEHCDKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-6-4-7(2-3-10-6)8(9)5-11/h2-5,8H,9H2,1H3.
What are the key properties of 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde?
2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde has a molecular weight of 150.18 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2-methyl-4-pyridinyl)acetaldehyde is sourced from PubChem (CID 87928859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).