2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide

C20H25N5O3 — CID 119048710

IUPAC2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide
SMILESCCn1cc(C2CN(C(=O)Nc3ccc(N4CCCC4=O)cc3)CCO2)cn1
InChIInChI=1S/C20H25N5O3/c1-2-24-13-15(12-21-24)18-14-23(10-11-28-18)20(27)22-16-5-7-17(8-6-16)25-9-3-4-19(25)26/h5-8,12-13,18H,2-4,9-11,14H2,1H3,(H,22,27)
InChIKeyRPJHZXVETKNXFD-UHFFFAOYSA-N
MW383.45 g/mol
LogP2.64
Rot. Bonds4

About 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide

2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide (PubChem CID 119048710) has the molecular formula C20H25N5O3 and a molecular weight of 383.45 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide
PubChem CID119048710
Molecular FormulaC20H25N5O3
Molecular Weight383.45 g/mol
Exact Mass383.20
IUPAC Name2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide
SMILESCCn1cc(C2CN(C(=O)Nc3ccc(N4CCCC4=O)cc3)CCO2)cn1
InChIInChI=1S/C20H25N5O3/c1-2-24-13-15(12-21-24)18-14-23(10-11-28-18)20(27)22-16-5-7-17(8-6-16)25-9-3-4-19(25)26/h5-8,12-13,18H,2-4,9-11,14H2,1H3,(H,22,27)
InChIKeyRPJHZXVETKNXFD-UHFFFAOYSA-N
XLogP2.64
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(1-ethylpyrazol-4-yl)morpholin-4-yl]prop-2-en-1-one
CID 126841376
(2R)-2-(1-ethylpyrazol-4-yl)-N-(5-propan-2-yl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 124624168
1-[4-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]phenyl]pyrrolidin-2-one
CID 38372185
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
4-(2-oxo-2-pyrrolidin-1-ylacetyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]piperazine-1-carboxamide
CID 55816776
5-methyl-1-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]piperidine-3-carboxylic acid
CID 167901294
(2R)-2-ethyl-N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-4-carboxamide
CID 124625433
(2R)-2-(4-ethylphenyl)-N-pyridazin-4-ylmorpholine-4-carboxamide
CID 129488391
1-[4-(2-ethylmorpholine-4-carbonyl)phenyl]pyrrolidin-2-one
CID 42943561
2-methyl-N-[5-[[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-pyridinyl]amino]-3-pyridinyl]morpholine-4-carboxamide
CID 142612293
1-ethyl-3-[4-(2-oxopyrrolidin-1-yl)phenyl]thiourea
CID 8716477
(2R)-N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-2-(4-fluorophenyl)morpholine-4-carboxamide
CID 95134155

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide (CID 119048710) is 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide is CCn1cc(C2CN(C(=O)Nc3ccc(N4CCCC4=O)cc3)CCO2)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide?
The InChIKey is RPJHZXVETKNXFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O3/c1-2-24-13-15(12-21-24)18-14-23(10-11-28-18)20(27)22-16-5-7-17(8-6-16)25-9-3-4-19(25)26/h5-8,12-13,18H,2-4,9-11,14H2,1H3,(H,22,27).
What are the key properties of 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide?
2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 119048710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).