N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide

C13H20N4O2 — CID 104535674

IUPACN-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1c1cncc(NC)c1
InChIInChI=1S/C13H20N4O2/c1-3-16-13(18)12-9-19-5-4-17(12)11-6-10(14-2)7-15-8-11/h6-8,12,14H,3-5,9H2,1-2H3,(H,16,18)
InChIKeyIQZYAMDWYCJFFJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.46
Rot. Bonds4

About N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide

N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide (PubChem CID 104535674) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide
PubChem CID104535674
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1c1cncc(NC)c1
InChIInChI=1S/C13H20N4O2/c1-3-16-13(18)12-9-19-5-4-17(12)11-6-10(14-2)7-15-8-11/h6-8,12,14H,3-5,9H2,1-2H3,(H,16,18)
InChIKeyIQZYAMDWYCJFFJ-UHFFFAOYSA-N
XLogP0.46
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide
CID 104535677
4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide
CID 104535670
N-methyl-4-[5-(propylamino)-3-pyridinyl]morpholine-3-carboxamide
CID 104535676
4-(5-amino-3-pyridinyl)-N-propylmorpholine-3-carboxamide
CID 104535679
4-(3-cyanophenyl)-N-ethylmorpholine-3-carboxamide
CID 102817134
4-(3-cyano-5-fluorophenyl)-N-ethylmorpholine-3-carboxamide
CID 102817135
4-[5-bromo-2-(methylamino)pyrimidin-4-yl]-N-ethylmorpholine-3-carboxamide
CID 83105980
N-ethyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83104234
4-(2-chloro-6-methylpyrimidin-4-yl)-N-ethylmorpholine-3-carboxamide
CID 83103546
4-(4-cyano-3-pyridinyl)-N-ethylmorpholine-3-carboxamide
CID 83098897
4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
CID 83107123
4-[2-chloro-4-(methylaminomethyl)phenyl]-N-ethylmorpholine-3-carboxamide
CID 83103969

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide?
The IUPAC name of N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide (CID 104535674) is N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide.
What is the SMILES notation for N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide?
The canonical SMILES for N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide is CCNC(=O)C1COCCN1c1cncc(NC)c1.
What is the InChIKey of N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide?
The InChIKey is IQZYAMDWYCJFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-3-16-13(18)12-9-19-5-4-17(12)11-6-10(14-2)7-15-8-11/h6-8,12,14H,3-5,9H2,1-2H3,(H,16,18).
What are the key properties of N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide?
N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide is sourced from PubChem (CID 104535674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).