4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide

C12H20N4O3 — CID 61214194

IUPAC4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
SMILESCOCCn1cc(NC(=O)C2CC(OC)CN2)cn1
InChIInChI=1S/C12H20N4O3/c1-18-4-3-16-8-9(6-14-16)15-12(17)11-5-10(19-2)7-13-11/h6,8,10-11,13H,3-5,7H2,1-2H3,(H,15,17)
InChIKeyKQLFOFXRERHVOM-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.16
Rot. Bonds6

About 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide

4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide (PubChem CID 61214194) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
PubChem CID61214194
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
SMILESCOCCn1cc(NC(=O)C2CC(OC)CN2)cn1
InChIInChI=1S/C12H20N4O3/c1-18-4-3-16-8-9(6-14-16)15-12(17)11-5-10(19-2)7-13-11/h6,8,10-11,13H,3-5,7H2,1-2H3,(H,15,17)
InChIKeyKQLFOFXRERHVOM-UHFFFAOYSA-N
XLogP-0.16
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide
CID 61213731
(2S,4S)-4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylpyrrolidine-2-carboxamide
CID 128979339
(2S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61179722
2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]cyclohexane-1-carboxamide
CID 64824534
4-methoxy-N-(1,2-oxazol-4-yl)pyrrolidine-2-carboxamide
CID 62902745
N-(4-butylphenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214462
4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide
CID 62327297
N-[1-(2-methoxyethyl)pyrazol-4-yl]but-2-enamide
CID 78968035
2-(cyclopentylamino)-N-[1-(2-methoxyethyl)pyrazol-4-yl]acetamide
CID 54928520
(2S,6S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]-2,6-dimethylmorpholine-4-carboxamide
CID 94156989
(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 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide?
The IUPAC name of 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide (CID 61214194) is 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide is COCCn1cc(NC(=O)C2CC(OC)CN2)cn1.
What is the InChIKey of 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide?
The InChIKey is KQLFOFXRERHVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-18-4-3-16-8-9(6-14-16)15-12(17)11-5-10(19-2)7-13-11/h6,8,10-11,13H,3-5,7H2,1-2H3,(H,15,17).
What are the key properties of 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide?
4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide has a molecular weight of 268.32 g/mol, XLogP of -0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 61214194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).