4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide

C14H19N3O4 — CID 83098981

IUPAC4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide
SMILESCC(O)c1ccc(NC(=O)N2CCOCC2C(N)=O)cc1
InChIInChI=1S/C14H19N3O4/c1-9(18)10-2-4-11(5-3-10)16-14(20)17-6-7-21-8-12(17)13(15)19/h2-5,9,12,18H,6-8H2,1H3,(H2,15,19)(H,16,20)
InChIKeyRNXOXKKKIXHWEB-UHFFFAOYSA-N
MW293.32 g/mol
LogP0.46
Rot. Bonds3

About 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide

4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide (PubChem CID 83098981) has the molecular formula C14H19N3O4 and a molecular weight of 293.32 g/mol. Its IUPAC name is 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide
PubChem CID83098981
Molecular FormulaC14H19N3O4
Molecular Weight293.32 g/mol
Exact Mass293.14
IUPAC Name4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide
SMILESCC(O)c1ccc(NC(=O)N2CCOCC2C(N)=O)cc1
InChIInChI=1S/C14H19N3O4/c1-9(18)10-2-4-11(5-3-10)16-14(20)17-6-7-21-8-12(17)13(15)19/h2-5,9,12,18H,6-8H2,1H3,(H2,15,19)(H,16,20)
InChIKeyRNXOXKKKIXHWEB-UHFFFAOYSA-N
XLogP0.46
TPSA104.89 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-amino-2-(4-methylphenyl)acetyl]morpholine-3-carboxamide
CID 106312666
2-[(3-carbamoylmorpholine-4-carbonyl)amino]-3-hydroxybutanoic acid
CID 83095908
4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
CID 83095626
4-(2-aminopropanoyl)morpholine-3-carboxamide
CID 83101341
N-[4-(2-methylpropanoylamino)phenyl]-3-(2-methylpropyl)morpholine-4-carboxamide
CID 56794682
(3S)-3-methyl-N-phenylmorpholine-4-carboxamide
CID 38887208
3-methyl-N-phenylmorpholine-4-carboxamide
CID 47166676
(3R)-3-methyl-N-phenylmorpholine-4-carboxamide
CID 38887206
(3S)-3-(2-methylpropyl)-N-phenylmorpholine-4-carboxamide
CID 95904890
N-[3-(1-aminoethyl)phenyl]-3-methylmorpholine-4-carboxamide
CID 61342049
N-cyclopropyl-4-[4-(1-hydroxyethyl)phenyl]morpholine-3-carboxamide
CID 83101406
N-[4-(1-hydroxyethyl)phenyl]-2,2-dimethylmorpholine-4-carboxamide
CID 61339795

Frequently Asked Questions

What is the IUPAC name of 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide?
The IUPAC name of 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide (CID 83098981) is 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide.
What is the SMILES notation for 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide?
The canonical SMILES for 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide is CC(O)c1ccc(NC(=O)N2CCOCC2C(N)=O)cc1.
What is the InChIKey of 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide?
The InChIKey is RNXOXKKKIXHWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O4/c1-9(18)10-2-4-11(5-3-10)16-14(20)17-6-7-21-8-12(17)13(15)19/h2-5,9,12,18H,6-8H2,1H3,(H2,15,19)(H,16,20).
What are the key properties of 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide?
4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide has a molecular weight of 293.32 g/mol, XLogP of 0.46, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide is sourced from PubChem (CID 83098981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).