10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane

C19H40N2O5 — CID 18341079

IUPAC10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane
SMILESCN1CCCOCCOCCCN(C)CCCOCOCCOCCC1
InChIInChI=1S/C19H40N2O5/c1-20-7-3-11-22-15-16-23-12-4-9-21(2)10-6-14-25-19-26-18-17-24-13-5-8-20/h3-19H2,1-2H3
InChIKeyCYCSDYDLOVSGQD-UHFFFAOYSA-N
MW376.54 g/mol
LogP1.46
Rot. Bonds

About 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane

10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane (PubChem CID 18341079) has the molecular formula C19H40N2O5 and a molecular weight of 376.54 g/mol. Its IUPAC name is 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane.

Molecular Properties

Compound Name10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane
PubChem CID18341079
Molecular FormulaC19H40N2O5
Molecular Weight376.54 g/mol
Exact Mass376.29
IUPAC Name10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane
SMILESCN1CCCOCCOCCCN(C)CCCOCOCCOCCC1
InChIInChI=1S/C19H40N2O5/c1-20-7-3-11-22-15-16-23-12-4-9-21(2)10-6-14-25-19-26-18-17-24-13-5-8-20/h3-19H2,1-2H3
InChIKeyCYCSDYDLOVSGQD-UHFFFAOYSA-N
XLogP1.46
TPSA52.63 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.54
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane with MolForge

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Related Compounds

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CID 139860202

Frequently Asked Questions

What is the IUPAC name of 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane?
The IUPAC name of 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane (CID 18341079) is 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane.
What is the SMILES notation for 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane?
The canonical SMILES for 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane is CN1CCCOCCOCCCN(C)CCCOCOCCOCCC1.
What is the InChIKey of 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane?
The InChIKey is CYCSDYDLOVSGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2O5/c1-20-7-3-11-22-15-16-23-12-4-9-21(2)10-6-14-25-19-26-18-17-24-13-5-8-20/h3-19H2,1-2H3.
What are the key properties of 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane?
10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane has a molecular weight of 376.54 g/mol, XLogP of 1.46, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 10,21-dimethyl-1,3,6,14,17-pentaoxa-10,21-diazacyclotetracosane is sourced from PubChem (CID 18341079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).