ethane;4-propylmorpholine

C11H27NO — CID 143004992

IUPACethane;4-propylmorpholine
SMILESCC.CC.CCCN1CCOCC1
InChIInChI=1S/C7H15NO.2C2H6/c1-2-3-8-4-6-9-7-5-8;2*1-2/h2-7H2,1H3;2*1-2H3
InChIKeyRVHXIRYHXNLTOV-UHFFFAOYSA-N
MW189.34 g/mol
LogP2.78
Rot. Bonds2

About ethane;4-propylmorpholine

ethane;4-propylmorpholine (PubChem CID 143004992) has the molecular formula C11H27NO and a molecular weight of 189.34 g/mol. Its IUPAC name is ethane;4-propylmorpholine.

Molecular Properties

Compound Nameethane;4-propylmorpholine
PubChem CID143004992
Molecular FormulaC11H27NO
Molecular Weight189.34 g/mol
Exact Mass189.21
IUPAC Nameethane;4-propylmorpholine
SMILESCC.CC.CCCN1CCOCC1
InChIInChI=1S/C7H15NO.2C2H6/c1-2-3-8-4-6-9-7-5-8;2*1-2/h2-7H2,1H3;2*1-2H3
InChIKeyRVHXIRYHXNLTOV-UHFFFAOYSA-N
XLogP2.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.34
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-propylmorpholine;hydrobromide
CID 70540609
16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71337150
CID 68598978
CID 68598978
methanamine;4-propyl-1,4-oxazepane
CID 169188972
butane;4-butylmorpholine
CID 177152600
4-hexylmorpholine
CID 3614751
1-[10-(2-hydroxypropyl)-7-propyl-1-oxa-4,7,10-triazacyclododec-4-yl]propan-2-ol
CID 142476457
propane-1-sulfonic acid;4-propylmorpholine
CID 118072968
ethane;4-(2-propoxyethyl)morpholine
CID 154661305
ethyl acetate;4-propylmorpholine
CID 160534633
4-propyl-1-oxa-4,9-diazacycloundecane
CID 142313411
4-[2-(4-methylpiperazin-1-yl)ethyl]morpholine
CID 20719664

Frequently Asked Questions

What is the IUPAC name of ethane;4-propylmorpholine?
The IUPAC name of ethane;4-propylmorpholine (CID 143004992) is ethane;4-propylmorpholine.
What is the SMILES notation for ethane;4-propylmorpholine?
The canonical SMILES for ethane;4-propylmorpholine is CC.CC.CCCN1CCOCC1.
What is the InChIKey of ethane;4-propylmorpholine?
The InChIKey is RVHXIRYHXNLTOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.2C2H6/c1-2-3-8-4-6-9-7-5-8;2*1-2/h2-7H2,1H3;2*1-2H3.
What are the key properties of ethane;4-propylmorpholine?
ethane;4-propylmorpholine has a molecular weight of 189.34 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-propylmorpholine is sourced from PubChem (CID 143004992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).