16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane

C15H31NO5 — CID 71337150

IUPAC16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
SMILESCCCN1CCOCCOCCOCCOCCOCC1
InChIInChI=1S/C15H31NO5/c1-2-3-16-4-6-17-8-10-19-12-14-21-15-13-20-11-9-18-7-5-16/h2-15H2,1H3
InChIKeyRLBYDZUUZHHEII-UHFFFAOYSA-N
MW305.42 g/mol
LogP0.80
Rot. Bonds2

About 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane

16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane (PubChem CID 71337150) has the molecular formula C15H31NO5 and a molecular weight of 305.42 g/mol. Its IUPAC name is 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane.

Molecular Properties

Compound Name16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
PubChem CID71337150
Molecular FormulaC15H31NO5
Molecular Weight305.42 g/mol
Exact Mass305.22
IUPAC Name16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
SMILESCCCN1CCOCCOCCOCCOCCOCC1
InChIInChI=1S/C15H31NO5/c1-2-3-16-4-6-17-8-10-19-12-14-21-15-13-20-11-9-18-7-5-16/h2-15H2,1H3
InChIKeyRLBYDZUUZHHEII-UHFFFAOYSA-N
XLogP0.80
TPSA49.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane 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

4-propylmorpholine;hydrobromide
CID 70540609
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
16-[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)decyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 15145347

Frequently Asked Questions

What is the IUPAC name of 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane?
The IUPAC name of 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane (CID 71337150) is 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane.
What is the SMILES notation for 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane?
The canonical SMILES for 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane is CCCN1CCOCCOCCOCCOCCOCC1.
What is the InChIKey of 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane?
The InChIKey is RLBYDZUUZHHEII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO5/c1-2-3-16-4-6-17-8-10-19-12-14-21-15-13-20-11-9-18-7-5-16/h2-15H2,1H3.
What are the key properties of 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane?
16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane has a molecular weight of 305.42 g/mol, XLogP of 0.80, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane is sourced from PubChem (CID 71337150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).