9-(1-cyclobutylideneethylamino)nonan-1-ol

C15H29NO — CID 174195445

IUPAC9-(1-cyclobutylideneethylamino)nonan-1-ol
SMILESCC(NCCCCCCCCCO)=C1CCC1
InChIInChI=1S/C15H29NO/c1-14(15-10-9-11-15)16-12-7-5-3-2-4-6-8-13-17/h16-17H,2-13H2,1H3
InChIKeyKHEZSQPOZYXZLK-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.76
Rot. Bonds10

About 9-(1-cyclobutylideneethylamino)nonan-1-ol

9-(1-cyclobutylideneethylamino)nonan-1-ol (PubChem CID 174195445) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 9-(1-cyclobutylideneethylamino)nonan-1-ol.

Molecular Properties

Compound Name9-(1-cyclobutylideneethylamino)nonan-1-ol
PubChem CID174195445
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name9-(1-cyclobutylideneethylamino)nonan-1-ol
SMILESCC(NCCCCCCCCCO)=C1CCC1
InChIInChI=1S/C15H29NO/c1-14(15-10-9-11-15)16-12-7-5-3-2-4-6-8-13-17/h16-17H,2-13H2,1H3
InChIKeyKHEZSQPOZYXZLK-UHFFFAOYSA-N
XLogP3.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.76
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 9-(1-cyclobutylideneethylamino)nonan-1-ol?
The IUPAC name of 9-(1-cyclobutylideneethylamino)nonan-1-ol (CID 174195445) is 9-(1-cyclobutylideneethylamino)nonan-1-ol.
What is the SMILES notation for 9-(1-cyclobutylideneethylamino)nonan-1-ol?
The canonical SMILES for 9-(1-cyclobutylideneethylamino)nonan-1-ol is CC(NCCCCCCCCCO)=C1CCC1.
What is the InChIKey of 9-(1-cyclobutylideneethylamino)nonan-1-ol?
The InChIKey is KHEZSQPOZYXZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-14(15-10-9-11-15)16-12-7-5-3-2-4-6-8-13-17/h16-17H,2-13H2,1H3.
What are the key properties of 9-(1-cyclobutylideneethylamino)nonan-1-ol?
9-(1-cyclobutylideneethylamino)nonan-1-ol has a molecular weight of 239.40 g/mol, XLogP of 3.76, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1-cyclobutylideneethylamino)nonan-1-ol is sourced from PubChem (CID 174195445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).