4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine

C14H26N2O2 — CID 113462192

IUPAC4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine
SMILESCC(CC1COCCN1)N1CCOC2CCCC21
InChIInChI=1S/C14H26N2O2/c1-11(9-12-10-17-7-5-15-12)16-6-8-18-14-4-2-3-13(14)16/h11-15H,2-10H2,1H3
InChIKeyGCZHQNLLECIKFQ-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.01
Rot. Bonds3

About 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine

4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine (PubChem CID 113462192) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine.

Molecular Properties

Compound Name4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine
PubChem CID113462192
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine
SMILESCC(CC1COCCN1)N1CCOC2CCCC21
InChIInChI=1S/C14H26N2O2/c1-11(9-12-10-17-7-5-15-12)16-6-8-18-14-4-2-3-13(14)16/h11-15H,2-10H2,1H3
InChIKeyGCZHQNLLECIKFQ-UHFFFAOYSA-N
XLogP1.01
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine?
The IUPAC name of 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine (CID 113462192) is 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine.
What is the SMILES notation for 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine?
The canonical SMILES for 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine is CC(CC1COCCN1)N1CCOC2CCCC21.
What is the InChIKey of 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine?
The InChIKey is GCZHQNLLECIKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11(9-12-10-17-7-5-15-12)16-6-8-18-14-4-2-3-13(14)16/h11-15H,2-10H2,1H3.
What are the key properties of 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine?
4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine has a molecular weight of 254.37 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-morpholin-3-ylpropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine is sourced from PubChem (CID 113462192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).