4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol

C11H23NO2 — CID 102848477

IUPAC4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol
SMILESOCCCCN(CCCO)C1CCC1
InChIInChI=1S/C11H23NO2/c13-9-2-1-7-12(8-4-10-14)11-5-3-6-11/h11,13-14H,1-10H2
InChIKeyGBXAHOKPVZQEGK-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.00
Rot. Bonds8

About 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol

4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol (PubChem CID 102848477) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol.

Molecular Properties

Compound Name4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol
PubChem CID102848477
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol
SMILESOCCCCN(CCCO)C1CCC1
InChIInChI=1S/C11H23NO2/c13-9-2-1-7-12(8-4-10-14)11-5-3-6-11/h11,13-14H,1-10H2
InChIKeyGBXAHOKPVZQEGK-UHFFFAOYSA-N
XLogP1.00
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[5-bromopentyl(cyclobutyl)amino]propan-1-ol
CID 102869386
6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol
CID 107707010
3-[cyclobutyl(2-fluoroethyl)amino]propan-1-ol
CID 102848338
3-[cyclopropyl(2-hydroxyethyl)amino]propan-1-ol
CID 61067850
3-[cyclobutyl(4-methoxybutyl)amino]propan-1-ol
CID 102848821
3-[3-[cyclohexyl(3-hydroxypropyl)amino]propylamino]propan-1-ol
CID 149151262
3-[cyclobutyl(3-hydroxypropyl)amino]propanal
CID 102864313
3-[cyclopentyl-[3-(cyclopentylamino)propyl]amino]propan-1-ol
CID 149152663
3-[cyclobutyl-[3-(ethylamino)propyl]amino]propan-1-ol
CID 102869544
3-[butyl(cyclopropyl)amino]propan-1-ol
CID 60969534
6-[cyclopentyl(2-methylpropyl)amino]hexan-1-ol
CID 103737867
3-[cyclobutyl-[2-(1,3-dioxan-2-yl)ethyl]amino]propan-1-ol
CID 102848652

Frequently Asked Questions

What is the IUPAC name of 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol?
The IUPAC name of 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol (CID 102848477) is 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol.
What is the SMILES notation for 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol?
The canonical SMILES for 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol is OCCCCN(CCCO)C1CCC1.
What is the InChIKey of 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol?
The InChIKey is GBXAHOKPVZQEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c13-9-2-1-7-12(8-4-10-14)11-5-3-6-11/h11,13-14H,1-10H2.
What are the key properties of 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol?
4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.00, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol is sourced from PubChem (CID 102848477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).