(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone

C13H19N3O2 — CID 94051637

IUPAC(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone
SMILESC[C@@H]1CO[C@@H](C)CN1C(=O)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C13H19N3O2/c1-8-7-18-9(2)6-16(8)13(17)12-5-11(14-15-12)10-3-4-10/h5,8-10H,3-4,6-7H2,1-2H3,(H,14,15)/t8-,9+/m1/s1
InChIKeyKCVLDHCBPVOYAN-BDAKNGLRSA-N
MW249.31 g/mol
LogP1.54
Rot. Bonds2

About (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone

(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone (PubChem CID 94051637) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone
PubChem CID94051637
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone
SMILESC[C@@H]1CO[C@@H](C)CN1C(=O)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C13H19N3O2/c1-8-7-18-9(2)6-16(8)13(17)12-5-11(14-15-12)10-3-4-10/h5,8-10H,3-4,6-7H2,1-2H3,(H,14,15)/t8-,9+/m1/s1
InChIKeyKCVLDHCBPVOYAN-BDAKNGLRSA-N
XLogP1.54
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone 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

[(3aR,4R,7S,7aS)-1,3,3a,4,5,6,7,7a-octahydro-4,7-epoxyisoindol-2-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone
CID 56872114
(5-cyclopropyl-1H-pyrazol-3-yl)-(2,2-dioxo-2λ6-thia-5-azabicyclo[2.2.1]heptan-5-yl)methanone
CID 122245307
[(1S,6S)-7-azabicyclo[4.2.0]octan-7-yl]-(5-cyclohexyl-1H-pyrazol-3-yl)methanone
CID 167762565
[(2S,5R)-2,5-dimethylmorpholin-4-yl]-(1,2,5-thiadiazol-3-yl)methanone
CID 94200534
N'-(2-amino-6-fluoro-8-methylquinazolin-4-yl)-1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-6-methylpiperidine-3-carboximidamide
CID 171652991
[2-(1-aminoethyl)piperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone;hydrochloride
CID 119434902
(6-amino-2-pyridinyl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 62238786
(5-cyclopropyl-1H-pyrazol-3-yl)-[3-(1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]methanone
CID 121019587
(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 47413889
4-(2,5-dimethylmorpholine-4-carbonyl)-2H-phthalazin-1-one
CID 43420923
(2,5-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone
CID 107374544
(1-chloroisoquinolin-3-yl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 43430222

Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone?
The IUPAC name of (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone (CID 94051637) is (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone.
What is the SMILES notation for (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone?
The canonical SMILES for (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone is C[C@@H]1CO[C@@H](C)CN1C(=O)c1cc(C2CC2)[nH]n1.
What is the InChIKey of (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone?
The InChIKey is KCVLDHCBPVOYAN-BDAKNGLRSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-8-7-18-9(2)6-16(8)13(17)12-5-11(14-15-12)10-3-4-10/h5,8-10H,3-4,6-7H2,1-2H3,(H,14,15)/t8-,9+/m1/s1.
What are the key properties of (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone?
(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone has a molecular weight of 249.31 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone is sourced from PubChem (CID 94051637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).