6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol

C16H28N2O2 — CID 66553675

IUPAC6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol
SMILESCc1cc(N)nc(CCCCCCCCCCO)c1O
InChIInChI=1S/C16H28N2O2/c1-13-12-15(17)18-14(16(13)20)10-8-6-4-2-3-5-7-9-11-19/h12,19-20H,2-11H2,1H3,(H2,17,18)
InChIKeyNNMFTGPIGKWTLP-UHFFFAOYSA-N
MW280.41 g/mol
LogP3.33
Rot. Bonds10

About 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol

6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol (PubChem CID 66553675) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol.

Molecular Properties

Compound Name6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol
PubChem CID66553675
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol
SMILESCc1cc(N)nc(CCCCCCCCCCO)c1O
InChIInChI=1S/C16H28N2O2/c1-13-12-15(17)18-14(16(13)20)10-8-6-4-2-3-5-7-9-11-19/h12,19-20H,2-11H2,1H3,(H2,17,18)
InChIKeyNNMFTGPIGKWTLP-UHFFFAOYSA-N
XLogP3.33
TPSA79.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol?
The IUPAC name of 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol (CID 66553675) is 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol.
What is the SMILES notation for 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol?
The canonical SMILES for 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol is Cc1cc(N)nc(CCCCCCCCCCO)c1O.
What is the InChIKey of 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol?
The InChIKey is NNMFTGPIGKWTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-13-12-15(17)18-14(16(13)20)10-8-6-4-2-3-5-7-9-11-19/h12,19-20H,2-11H2,1H3,(H2,17,18).
What are the key properties of 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol?
6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol has a molecular weight of 280.41 g/mol, XLogP of 3.33, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-(10-hydroxydecyl)-4-methylpyridin-3-ol is sourced from PubChem (CID 66553675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).