4-propylmorpholine;hydrobromide

C7H16BrNO — CID 70540609

IUPAC4-propylmorpholine;hydrobromide
SMILESBr.CCCN1CCOCC1
InChIInChI=1S/C7H15NO.BrH/c1-2-3-8-4-6-9-7-5-8;/h2-7H2,1H3;1H
InChIKeyCPFSHRDQDNWAMQ-UHFFFAOYSA-N
MW210.11 g/mol
LogP1.31
Rot. Bonds2

About 4-propylmorpholine;hydrobromide

4-propylmorpholine;hydrobromide (PubChem CID 70540609) has the molecular formula C7H16BrNO and a molecular weight of 210.11 g/mol. Its IUPAC name is 4-propylmorpholine;hydrobromide.

Molecular Properties

Compound Name4-propylmorpholine;hydrobromide
PubChem CID70540609
Molecular FormulaC7H16BrNO
Molecular Weight210.11 g/mol
Exact Mass209.04
IUPAC Name4-propylmorpholine;hydrobromide
SMILESBr.CCCN1CCOCC1
InChIInChI=1S/C7H15NO.BrH/c1-2-3-8-4-6-9-7-5-8;/h2-7H2,1H3;1H
InChIKeyCPFSHRDQDNWAMQ-UHFFFAOYSA-N
XLogP1.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.11
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-propylmorpholine;hydrobromide 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

16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71337150
ethane;4-propylmorpholine
CID 143004992
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
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
4-(2-ethoxyethyl)morpholine;hydrobromide
CID 173067075

Frequently Asked Questions

What is the IUPAC name of 4-propylmorpholine;hydrobromide?
The IUPAC name of 4-propylmorpholine;hydrobromide (CID 70540609) is 4-propylmorpholine;hydrobromide.
What is the SMILES notation for 4-propylmorpholine;hydrobromide?
The canonical SMILES for 4-propylmorpholine;hydrobromide is Br.CCCN1CCOCC1.
What is the InChIKey of 4-propylmorpholine;hydrobromide?
The InChIKey is CPFSHRDQDNWAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.BrH/c1-2-3-8-4-6-9-7-5-8;/h2-7H2,1H3;1H.
What are the key properties of 4-propylmorpholine;hydrobromide?
4-propylmorpholine;hydrobromide has a molecular weight of 210.11 g/mol, XLogP of 1.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propylmorpholine;hydrobromide is sourced from PubChem (CID 70540609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).