N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide

C14H20N4O3 — CID 119755895

IUPACN-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
SMILESCCNC(=O)Nc1cccc(NC(=O)C2CNCCO2)c1
InChIInChI=1S/C14H20N4O3/c1-2-16-14(20)18-11-5-3-4-10(8-11)17-13(19)12-9-15-6-7-21-12/h3-5,8,12,15H,2,6-7,9H2,1H3,(H,17,19)(H2,16,18,20)
InChIKeyCCGNNIAAMCUTSI-UHFFFAOYSA-N
MW292.34 g/mol
LogP0.75
Rot. Bonds4

About N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide

N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide (PubChem CID 119755895) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
PubChem CID119755895
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC NameN-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
SMILESCCNC(=O)Nc1cccc(NC(=O)C2CNCCO2)c1
InChIInChI=1S/C14H20N4O3/c1-2-16-14(20)18-11-5-3-4-10(8-11)17-13(19)12-9-15-6-7-21-12/h3-5,8,12,15H,2,6-7,9H2,1H3,(H,17,19)(H2,16,18,20)
InChIKeyCCGNNIAAMCUTSI-UHFFFAOYSA-N
XLogP0.75
TPSA91.49 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 50.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide?
The IUPAC name of N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide (CID 119755895) is N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide is CCNC(=O)Nc1cccc(NC(=O)C2CNCCO2)c1.
What is the InChIKey of N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide?
The InChIKey is CCGNNIAAMCUTSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-2-16-14(20)18-11-5-3-4-10(8-11)17-13(19)12-9-15-6-7-21-12/h3-5,8,12,15H,2,6-7,9H2,1H3,(H,17,19)(H2,16,18,20).
What are the key properties of N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide?
N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 0.75, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119755895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).