5-(oxan-4-ylmethylamino)pentan-1-ol

C11H23NO2 — CID 63711155

IUPAC5-(oxan-4-ylmethylamino)pentan-1-ol
SMILESOCCCCCNCC1CCOCC1
InChIInChI=1S/C11H23NO2/c13-7-3-1-2-6-12-10-11-4-8-14-9-5-11/h11-13H,1-10H2
InChIKeyAKOYEEUDKHAURT-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.17
Rot. Bonds7

About 5-(oxan-4-ylmethylamino)pentan-1-ol

5-(oxan-4-ylmethylamino)pentan-1-ol (PubChem CID 63711155) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 5-(oxan-4-ylmethylamino)pentan-1-ol.

Molecular Properties

Compound Name5-(oxan-4-ylmethylamino)pentan-1-ol
PubChem CID63711155
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name5-(oxan-4-ylmethylamino)pentan-1-ol
SMILESOCCCCCNCC1CCOCC1
InChIInChI=1S/C11H23NO2/c13-7-3-1-2-6-12-10-11-4-8-14-9-5-11/h11-13H,1-10H2
InChIKeyAKOYEEUDKHAURT-UHFFFAOYSA-N
XLogP1.17
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(oxan-4-ylmethylamino)pentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-N-(oxan-4-ylmethyl)pentan-1-amine
CID 107320411
5-methoxy-N-(oxan-4-ylmethyl)pentan-1-amine
CID 115685550
2,2-dimethyl-5-(oxan-4-ylmethylamino)pentan-1-ol
CID 115685739
6-[(4-tert-butylcyclohexyl)methylamino]hexan-1-ol
CID 107849266
6-[(3-methylcyclopentyl)methylamino]hexan-1-ol
CID 107703705
2-methyl-4-(oxan-4-ylmethylamino)butan-2-ol
CID 79355568
6-(1,4-dioxan-2-ylmethylamino)hexan-1-ol
CID 107703242
3-(cyclooctylmethylamino)propan-1-ol
CID 115674336
N'-cyclohexyl-N'-methyl-N-(oxan-4-ylmethyl)propane-1,3-diamine
CID 55066114
3-methyl-N-(oxan-4-ylmethyl)butan-1-amine
CID 62385670
6-(cyclohex-3-en-1-ylmethylamino)hexan-1-ol
CID 115908967
N'-(oxan-4-ylmethyl)methanediamine
CID 115225805

Frequently Asked Questions

What is the IUPAC name of 5-(oxan-4-ylmethylamino)pentan-1-ol?
The IUPAC name of 5-(oxan-4-ylmethylamino)pentan-1-ol (CID 63711155) is 5-(oxan-4-ylmethylamino)pentan-1-ol.
What is the SMILES notation for 5-(oxan-4-ylmethylamino)pentan-1-ol?
The canonical SMILES for 5-(oxan-4-ylmethylamino)pentan-1-ol is OCCCCCNCC1CCOCC1.
What is the InChIKey of 5-(oxan-4-ylmethylamino)pentan-1-ol?
The InChIKey is AKOYEEUDKHAURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c13-7-3-1-2-6-12-10-11-4-8-14-9-5-11/h11-13H,1-10H2.
What are the key properties of 5-(oxan-4-ylmethylamino)pentan-1-ol?
5-(oxan-4-ylmethylamino)pentan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.17, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxan-4-ylmethylamino)pentan-1-ol is sourced from PubChem (CID 63711155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).