N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide

C10H18N2O3 — CID 83103810

IUPACN-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1CC(C)=O
InChIInChI=1S/C10H18N2O3/c1-3-11-10(14)9-7-15-5-4-12(9)6-8(2)13/h9H,3-7H2,1-2H3,(H,11,14)
InChIKeyBPVSCLFNTCUMLU-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.59
Rot. Bonds4

About N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide

N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide (PubChem CID 83103810) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide
PubChem CID83103810
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1CC(C)=O
InChIInChI=1S/C10H18N2O3/c1-3-11-10(14)9-7-15-5-4-12(9)6-8(2)13/h9H,3-7H2,1-2H3,(H,11,14)
InChIKeyBPVSCLFNTCUMLU-UHFFFAOYSA-N
XLogP-0.59
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide?
The IUPAC name of N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide (CID 83103810) is N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide.
What is the SMILES notation for N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide?
The canonical SMILES for N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide is CCNC(=O)C1COCCN1CC(C)=O.
What is the InChIKey of N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide?
The InChIKey is BPVSCLFNTCUMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-3-11-10(14)9-7-15-5-4-12(9)6-8(2)13/h9H,3-7H2,1-2H3,(H,11,14).
What are the key properties of N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide?
N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide has a molecular weight of 214.26 g/mol, XLogP of -0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide is sourced from PubChem (CID 83103810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).