4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide

C14H25N5O2 — CID 83103965

IUPAC4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1c1c(CNC)c(C)nn1C
InChIInChI=1S/C14H25N5O2/c1-5-16-13(20)12-9-21-7-6-19(12)14-11(8-15-3)10(2)17-18(14)4/h12,15H,5-9H2,1-4H3,(H,16,20)
InChIKeyZNTMYBWFKMMDDT-UHFFFAOYSA-N
MW295.39 g/mol
LogP-0.21
Rot. Bonds5

About 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide

4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide (PubChem CID 83103965) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide
PubChem CID83103965
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC Name4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1c1c(CNC)c(C)nn1C
InChIInChI=1S/C14H25N5O2/c1-5-16-13(20)12-9-21-7-6-19(12)14-11(8-15-3)10(2)17-18(14)4/h12,15H,5-9H2,1-4H3,(H,16,20)
InChIKeyZNTMYBWFKMMDDT-UHFFFAOYSA-N
XLogP-0.21
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(hydroxymethyl)-1,3-dimethylpyrazol-5-yl]-N-propylmorpholine-3-carboxamide
CID 83101398
4-[2-chloro-4-(methylaminomethyl)phenyl]-N-ethylmorpholine-3-carboxamide
CID 83103969
N-ethyl-4-[4-fluoro-2-(methylaminomethyl)phenyl]morpholine-3-carboxamide
CID 83103963
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
N-ethyl-4-[5-(methylamino)-3-pyridinyl]morpholine-3-carboxamide
CID 104535674
N-ethyl-4-[2-fluoro-4-(hydroxymethyl)phenyl]morpholine-3-carboxamide
CID 83102955
N-ethyl-4-[6-(ethylamino)-5-methylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83105968
4-(6-amino-5-ethylpyrimidin-4-yl)-N-ethylmorpholine-3-carboxamide
CID 83105787
1-[5-(5-ethyl-2-methylmorpholin-4-yl)-1,3-dimethylpyrazol-4-yl]-N-methylmethanamine
CID 61424154
4-(4-cyanopyridazin-3-yl)-N-ethylmorpholine-3-carboxamide
CID 83097290
4-(4-cyano-2,3-difluorophenyl)-N-ethylmorpholine-3-carboxamide
CID 107934083

Frequently Asked Questions

What is the IUPAC name of 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide?
The IUPAC name of 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide (CID 83103965) is 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide?
The canonical SMILES for 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide is CCNC(=O)C1COCCN1c1c(CNC)c(C)nn1C.
What is the InChIKey of 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide?
The InChIKey is ZNTMYBWFKMMDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-5-16-13(20)12-9-21-7-6-19(12)14-11(8-15-3)10(2)17-18(14)4/h12,15H,5-9H2,1-4H3,(H,16,20).
What are the key properties of 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide?
4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide has a molecular weight of 295.39 g/mol, XLogP of -0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]-N-ethylmorpholine-3-carboxamide is sourced from PubChem (CID 83103965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).