N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide

C12H20N4O2 — CID 118740635

IUPACN-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
SMILESCNC(=O)N1CCOCC1c1c(C)nn(C)c1C
InChIInChI=1S/C12H20N4O2/c1-8-11(9(2)15(4)14-8)10-7-18-6-5-16(10)12(17)13-3/h10H,5-7H2,1-4H3,(H,13,17)
InChIKeySSBUJKAWFKOUQG-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.75
Rot. Bonds1

About N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide

N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide (PubChem CID 118740635) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
PubChem CID118740635
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC NameN-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
SMILESCNC(=O)N1CCOCC1c1c(C)nn(C)c1C
InChIInChI=1S/C12H20N4O2/c1-8-11(9(2)15(4)14-8)10-7-18-6-5-16(10)12(17)13-3/h10H,5-7H2,1-4H3,(H,13,17)
InChIKeySSBUJKAWFKOUQG-UHFFFAOYSA-N
XLogP0.75
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Morpholin-4-yl-(3,4,5-trimethyl-pyrazol-1-yl)-methanone
CID 973775
3-(3-Ethoxypropyl)-1-[(1,3,5-trimethyl-1H-pyrazol-4-YL)methyl]urea
CID 20964086
N-(2-methoxyethyl)-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
CID 75399233
N-(oxan-3-yl)-3-(3,4,5-trimethylpyrazol-1-yl)propanamide
CID 110226048
3,3-Dimethyl-1-[3-(1,3,5-trimethylpyrazol-4-yl)morpholin-4-yl]butan-1-one
CID 118740636
N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
CID 118740637
N,N-diethyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
CID 118740638
3-(trimethyl-1H-pyrazol-4-yl)morpholine
CID 71695346
3-(3-Ethoxypropyl)-1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-YL)methyl]urea
CID 20964146
N-[[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]methyl]-4-propan-2-ylpiperidine-1-carboxamide
CID 71868463
3-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-methylurea
CID 125439197
1-[2-hydroxy-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]-3-[(3R)-oxan-3-yl]urea
CID 138010365

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
The IUPAC name of N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide (CID 118740635) is N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
The canonical SMILES for N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide is CNC(=O)N1CCOCC1c1c(C)nn(C)c1C.
What is the InChIKey of N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
The InChIKey is SSBUJKAWFKOUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-8-11(9(2)15(4)14-8)10-7-18-6-5-16(10)12(17)13-3/h10H,5-7H2,1-4H3,(H,13,17).
What are the key properties of N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide is sourced from PubChem (CID 118740635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).