N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide

C14H21N5O2 — CID 167744728

IUPACN-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCCn1ccc(NC(=O)C2CC(=O)N(C3CN(C)C3)C2)n1
InChIInChI=1S/C14H21N5O2/c1-3-18-5-4-12(16-18)15-14(21)10-6-13(20)19(7-10)11-8-17(2)9-11/h4-5,10-11H,3,6-9H2,1-2H3,(H,15,16,21)
InChIKeySHRXVAYSVCPCAJ-UHFFFAOYSA-N
MW291.36 g/mol
LogP0.00
Rot. Bonds4

About N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide

N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 167744728) has the molecular formula C14H21N5O2 and a molecular weight of 291.36 g/mol. Its IUPAC name is N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID167744728
Molecular FormulaC14H21N5O2
Molecular Weight291.36 g/mol
Exact Mass291.17
IUPAC NameN-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCCn1ccc(NC(=O)C2CC(=O)N(C3CN(C)C3)C2)n1
InChIInChI=1S/C14H21N5O2/c1-3-18-5-4-12(16-18)15-14(21)10-6-13(20)19(7-10)11-8-17(2)9-11/h4-5,10-11H,3,6-9H2,1-2H3,(H,15,16,21)
InChIKeySHRXVAYSVCPCAJ-UHFFFAOYSA-N
XLogP0.00
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.36
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethyl-5-methylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 154768485
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 166248205
N-(5-fluoro-3-pyridinyl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 154768459
(2R,3R)-N-(1-ethylpyrazol-3-yl)-1-methyl-2-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 97457095
N-[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 167941362
(3R)-1-cyclopropyl-N-(3,4-diethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 38207326
5-(cyclopentanecarbonylamino)-N-(1-ethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide
CID 51999721
2-[3-[[1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]pyrazol-1-yl]acetic acid
CID 119231220
2-[3-[[(3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carbonyl]amino]pyrazol-1-yl]acetic acid
CID 125152670
2-[3-[[(3R)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]pyrazol-1-yl]acetic acid
CID 125132512
(3S)-1-cyclopropyl-5-oxo-N-(1-propylbenzimidazol-2-yl)pyrrolidine-3-carboxamide
CID 36809640
1-(4-ethylphenyl)-5-oxo-N-(1-phenylpyrazol-3-yl)pyrrolidine-3-carboxamide
CID 55537345

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide (CID 167744728) is N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide is CCn1ccc(NC(=O)C2CC(=O)N(C3CN(C)C3)C2)n1.
What is the InChIKey of N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is SHRXVAYSVCPCAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-3-18-5-4-12(16-18)15-14(21)10-6-13(20)19(7-10)11-8-17(2)9-11/h4-5,10-11H,3,6-9H2,1-2H3,(H,15,16,21).
What are the key properties of N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide?
N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 291.36 g/mol, XLogP of 0.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-3-yl)-1-(1-methylazetidin-3-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 167744728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).