(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide

C13H22N4O3 — CID 128979339

IUPAC(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide
SMILESCOCCn1cc(NC(=O)[C@@H]2C[C@H](OC)CN2C)cn1
InChIInChI=1S/C13H22N4O3/c1-16-9-11(20-3)6-12(16)13(18)15-10-7-14-17(8-10)4-5-19-2/h7-8,11-12H,4-6,9H2,1-3H3,(H,15,18)/t11-,12-/m0/s1
InChIKeyOZIHILOPDGFLGH-RYUDHWBXSA-N
MW282.34 g/mol
LogP0.19
Rot. Bonds6

About (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide

(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide (PubChem CID 128979339) has the molecular formula C13H22N4O3 and a molecular weight of 282.34 g/mol. Its IUPAC name is (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide
PubChem CID128979339
Molecular FormulaC13H22N4O3
Molecular Weight282.34 g/mol
Exact Mass282.17
IUPAC Name(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide
SMILESCOCCn1cc(NC(=O)[C@@H]2C[C@H](OC)CN2C)cn1
InChIInChI=1S/C13H22N4O3/c1-16-9-11(20-3)6-12(16)13(18)15-10-7-14-17(8-10)4-5-19-2/h7-8,11-12H,4-6,9H2,1-3H3,(H,15,18)/t11-,12-/m0/s1
InChIKeyOZIHILOPDGFLGH-RYUDHWBXSA-N
XLogP0.19
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-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

4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61214194
2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]cyclohexane-1-carboxamide
CID 64824534
(2S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61179722
(2S,4S)-4-methoxy-1-methyl-N-(2-phenylpyrimidin-5-yl)pyrrolidine-2-carboxamide
CID 128977951
(2S,6S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]-2,6-dimethylmorpholine-4-carboxamide
CID 94156989
1-[(1-ethylpyrazol-4-yl)carbamoyl]-4-methoxypyrrolidine-2-carboxylic acid
CID 61209916
4-(4-fluorophenyl)-N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methylpyrrolidine-1-carboxamide
CID 136526815
N-[1-(2-methoxyethyl)pyrazol-4-yl]but-2-enamide
CID 78968035
2-(cyclopentylamino)-N-[1-(2-methoxyethyl)pyrazol-4-yl]acetamide
CID 54928520
4-amino-5-[[1-(2-methoxyethyl)pyrazol-4-yl]amino]-5-oxopentanoic acid
CID 64895222
(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride
CID 119292252
2,6-dihydroxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 103749044

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide?
The IUPAC name of (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide (CID 128979339) is (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide?
The canonical SMILES for (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide is COCCn1cc(NC(=O)[C@@H]2C[C@H](OC)CN2C)cn1.
What is the InChIKey of (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide?
The InChIKey is OZIHILOPDGFLGH-RYUDHWBXSA-N. The full InChI is InChI=1S/C13H22N4O3/c1-16-9-11(20-3)6-12(16)13(18)15-10-7-14-17(8-10)4-5-19-2/h7-8,11-12H,4-6,9H2,1-3H3,(H,15,18)/t11-,12-/m0/s1.
What are the key properties of (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide?
(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 0.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 128979339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).