(2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide

C13H17N5O3 — CID 164640734

IUPAC(2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide
SMILESCn1nccc1[C@@H]1CN(C(=O)NCc2ccon2)CCO1
InChIInChI=1S/C13H17N5O3/c1-17-11(2-4-15-17)12-9-18(5-7-20-12)13(19)14-8-10-3-6-21-16-10/h2-4,6,12H,5,7-9H2,1H3,(H,14,19)/t12-/m0/s1
InChIKeyNVCCMPWIHTYZRD-LBPRGKRZSA-N
MW291.31 g/mol
LogP0.69
Rot. Bonds3

About (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide

(2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide (PubChem CID 164640734) has the molecular formula C13H17N5O3 and a molecular weight of 291.31 g/mol. Its IUPAC name is (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide
PubChem CID164640734
Molecular FormulaC13H17N5O3
Molecular Weight291.31 g/mol
Exact Mass291.13
IUPAC Name(2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide
SMILESCn1nccc1[C@@H]1CN(C(=O)NCc2ccon2)CCO1
InChIInChI=1S/C13H17N5O3/c1-17-11(2-4-15-17)12-9-18(5-7-20-12)13(19)14-8-10-3-6-21-16-10/h2-4,6,12H,5,7-9H2,1H3,(H,14,19)/t12-/m0/s1
InChIKeyNVCCMPWIHTYZRD-LBPRGKRZSA-N
XLogP0.69
TPSA85.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)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

2-methyl-N-(1,2-oxazol-3-ylmethyl)-1,4-oxazepane-4-carboxamide
CID 119064727
N-(1,2-oxazol-3-ylmethyl)azetidine-1-carboxamide
CID 131176570
(2R)-2-[2-(dimethylamino)pyrimidin-4-yl]-N-[(2-methylpyrazol-3-yl)methyl]morpholine-4-carboxamide
CID 129473669
3-[1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidin-4-yl]propanoic acid
CID 81177584
N-[(2-methylpyrimidin-4-yl)methyl]-2-(2-phenylethyl)morpholine-4-carboxamide
CID 75477456
2-methyl-1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidine-4-carboxylic acid
CID 106744445
2-benzyl-N-[(2-methylpyrazol-3-yl)methyl]morpholine-4-carboxamide
CID 75445414
N-methyl-2-[2-(2-methylpyrazol-3-yl)morpholin-4-yl]-N-(oxan-3-ylmethyl)-2-oxoacetamide
CID 166258930
(2S)-N-[(4-ethyl-2-pyridinyl)methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 100752575
2-(2-methylpyrazol-3-yl)-4-propylsulfonylmorpholine
CID 138051484
2-ethyl-1-(1,2-oxazol-3-ylmethylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 83070554
1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidine-2-carboxylic acid
CID 81178491

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide?
The IUPAC name of (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide (CID 164640734) is (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide.
What is the SMILES notation for (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide?
The canonical SMILES for (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide is Cn1nccc1[C@@H]1CN(C(=O)NCc2ccon2)CCO1.
What is the InChIKey of (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide?
The InChIKey is NVCCMPWIHTYZRD-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H17N5O3/c1-17-11(2-4-15-17)12-9-18(5-7-20-12)13(19)14-8-10-3-6-21-16-10/h2-4,6,12H,5,7-9H2,1H3,(H,14,19)/t12-/m0/s1.
What are the key properties of (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide?
(2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide has a molecular weight of 291.31 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-methylpyrazol-3-yl)-N-(1,2-oxazol-3-ylmethyl)morpholine-4-carboxamide is sourced from PubChem (CID 164640734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).