11-(methylamino)undecan-1-ol

C12H27NO — CID 19767274

IUPAC11-(methylamino)undecan-1-ol
SMILESCNCCCCCCCCCCCO
InChIInChI=1S/C12H27NO/c1-13-11-9-7-5-3-2-4-6-8-10-12-14/h13-14H,2-12H2,1H3
InChIKeyVYBQBSGDKAHCPI-UHFFFAOYSA-N
MW201.35 g/mol
LogP2.71
Rot. Bonds11

About 11-(methylamino)undecan-1-ol

11-(methylamino)undecan-1-ol (PubChem CID 19767274) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is 11-(methylamino)undecan-1-ol.

Molecular Properties

Compound Name11-(methylamino)undecan-1-ol
PubChem CID19767274
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name11-(methylamino)undecan-1-ol
SMILESCNCCCCCCCCCCCO
InChIInChI=1S/C12H27NO/c1-13-11-9-7-5-3-2-4-6-8-10-12-14/h13-14H,2-12H2,1H3
InChIKeyVYBQBSGDKAHCPI-UHFFFAOYSA-N
XLogP2.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 11-(methylamino)undecan-1-ol?
The IUPAC name of 11-(methylamino)undecan-1-ol (CID 19767274) is 11-(methylamino)undecan-1-ol.
What is the SMILES notation for 11-(methylamino)undecan-1-ol?
The canonical SMILES for 11-(methylamino)undecan-1-ol is CNCCCCCCCCCCCO.
What is the InChIKey of 11-(methylamino)undecan-1-ol?
The InChIKey is VYBQBSGDKAHCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-13-11-9-7-5-3-2-4-6-8-10-12-14/h13-14H,2-12H2,1H3.
What are the key properties of 11-(methylamino)undecan-1-ol?
11-(methylamino)undecan-1-ol has a molecular weight of 201.35 g/mol, XLogP of 2.71, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(methylamino)undecan-1-ol is sourced from PubChem (CID 19767274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).