ethane;4-morpholin-4-ylbutan-1-ol

C10H23NO2 — CID 162683886

IUPACethane;4-morpholin-4-ylbutan-1-ol
SMILESCC.OCCCCN1CCOCC1
InChIInChI=1S/C8H17NO2.C2H6/c10-6-2-1-3-9-4-7-11-8-5-9;1-2/h10H,1-8H2;1-2H3
InChIKeyILEHUWIBMXGQKY-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.12
Rot. Bonds4

About ethane;4-morpholin-4-ylbutan-1-ol

ethane;4-morpholin-4-ylbutan-1-ol (PubChem CID 162683886) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is ethane;4-morpholin-4-ylbutan-1-ol.

Molecular Properties

Compound Nameethane;4-morpholin-4-ylbutan-1-ol
PubChem CID162683886
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Nameethane;4-morpholin-4-ylbutan-1-ol
SMILESCC.OCCCCN1CCOCC1
InChIInChI=1S/C8H17NO2.C2H6/c10-6-2-1-3-9-4-7-11-8-5-9;1-2/h10H,1-8H2;1-2H3
InChIKeyILEHUWIBMXGQKY-UHFFFAOYSA-N
XLogP1.12
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

9-morpholin-4-ylnonan-1-ol
CID 58205558
20-morpholin-4-ylicosan-1-ol
CID 58205553
3-[2-hydroxyethyl(3-morpholin-4-ylpropyl)amino]propan-1-ol
CID 23551083
7-(2-morpholin-4-ylethoxy)heptan-1-ol
CID 123873926
5-(3-morpholin-4-ylpropylamino)pentan-1-ol
CID 62227528
ethane;3-ethyl-7-morpholin-4-ylheptan-1-ol
CID 144711905
16-[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)decyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 15145347
5-hydroxy-N-(3-morpholin-4-ylpropyl)pentanamide
CID 79199883
4-hexylmorpholine
CID 3614751
(3S)-3-methyl-6-morpholin-4-ylhexan-1-ol
CID 174809295
4-(3-bromopropyl)morpholine
CID 13034048
(3R)-7-morpholin-4-yl-3-propylheptan-1-ol
CID 118890062

Frequently Asked Questions

What is the IUPAC name of ethane;4-morpholin-4-ylbutan-1-ol?
The IUPAC name of ethane;4-morpholin-4-ylbutan-1-ol (CID 162683886) is ethane;4-morpholin-4-ylbutan-1-ol.
What is the SMILES notation for ethane;4-morpholin-4-ylbutan-1-ol?
The canonical SMILES for ethane;4-morpholin-4-ylbutan-1-ol is CC.OCCCCN1CCOCC1.
What is the InChIKey of ethane;4-morpholin-4-ylbutan-1-ol?
The InChIKey is ILEHUWIBMXGQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2.C2H6/c10-6-2-1-3-9-4-7-11-8-5-9;1-2/h10H,1-8H2;1-2H3.
What are the key properties of ethane;4-morpholin-4-ylbutan-1-ol?
ethane;4-morpholin-4-ylbutan-1-ol has a molecular weight of 189.30 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-morpholin-4-ylbutan-1-ol is sourced from PubChem (CID 162683886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).