4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide

C14H25N3O4 — CID 83098017

IUPAC4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide
SMILESCCCNC(=O)C1COCCN1C(=O)C1COCC1NC
InChIInChI=1S/C14H25N3O4/c1-3-4-16-13(18)12-9-20-6-5-17(12)14(19)10-7-21-8-11(10)15-2/h10-12,15H,3-9H2,1-2H3,(H,16,18)
InChIKeyOYUSTCWMPSMGBL-UHFFFAOYSA-N
MW299.37 g/mol
LogP-1.03
Rot. Bonds5

About 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide

4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide (PubChem CID 83098017) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide
PubChem CID83098017
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC Name4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide
SMILESCCCNC(=O)C1COCCN1C(=O)C1COCC1NC
InChIInChI=1S/C14H25N3O4/c1-3-4-16-13(18)12-9-20-6-5-17(12)14(19)10-7-21-8-11(10)15-2/h10-12,15H,3-9H2,1-2H3,(H,16,18)
InChIKeyOYUSTCWMPSMGBL-UHFFFAOYSA-N
XLogP-1.03
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-(methylamino)oxolane-3-carbonyl]-N-propan-2-ylmorpholine-3-carboxamide
CID 83098461
4-[4-(ethylamino)oxolane-3-carbonyl]-N-methylmorpholine-3-carboxamide
CID 83098007
(3-ethylmorpholin-4-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 66266572
3-N-propylmorpholine-3,4-dicarboxamide
CID 83106321
4-[2-(methylamino)propanoyl]-N-propylmorpholine-3-carboxamide
CID 83097059
4-N-butyl-3-N-propylmorpholine-3,4-dicarboxamide
CID 116657442
4-(3-aminopropanoyl)-N-propylmorpholine-3-carboxamide
CID 83106811
2-[methyl-[3-(propylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
CID 83103120
4-[2-(cyanomethylamino)-2-oxoacetyl]-N-propylmorpholine-3-carboxamide
CID 83097670
4-(2-bromo-3-methylbutanoyl)-N-propylmorpholine-3-carboxamide
CID 83106243
2-methyl-2-[[3-(propylcarbamoyl)morpholine-4-carbonyl]amino]propanoic acid
CID 83104560
4-(1-cyanocyclopentanecarbonyl)-N-propylmorpholine-3-carboxamide
CID 83096887

Frequently Asked Questions

What is the IUPAC name of 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide?
The IUPAC name of 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide (CID 83098017) is 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide?
The canonical SMILES for 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide is CCCNC(=O)C1COCCN1C(=O)C1COCC1NC.
What is the InChIKey of 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide?
The InChIKey is OYUSTCWMPSMGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c1-3-4-16-13(18)12-9-20-6-5-17(12)14(19)10-7-21-8-11(10)15-2/h10-12,15H,3-9H2,1-2H3,(H,16,18).
What are the key properties of 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide?
4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide has a molecular weight of 299.37 g/mol, XLogP of -1.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(methylamino)oxolane-3-carbonyl]-N-propylmorpholine-3-carboxamide is sourced from PubChem (CID 83098017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).