1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole

C11H19N3 — CID 99978633

IUPAC1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
SMILESCCn1nc(C)c([C@H]2CCCN2)c1C
InChIInChI=1S/C11H19N3/c1-4-14-9(3)11(8(2)13-14)10-6-5-7-12-10/h10,12H,4-7H2,1-3H3/t10-/m1/s1
InChIKeyOWJVJDYZYPZIIQ-SNVBAGLBSA-N
MW193.29 g/mol
LogP1.94
Rot. Bonds2

About 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole

1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole (PubChem CID 99978633) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole.

Molecular Properties

Compound Name1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
PubChem CID99978633
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
SMILESCCn1nc(C)c([C@H]2CCCN2)c1C
InChIInChI=1S/C11H19N3/c1-4-14-9(3)11(8(2)13-14)10-6-5-7-12-10/h10,12H,4-7H2,1-3H3/t10-/m1/s1
InChIKeyOWJVJDYZYPZIIQ-SNVBAGLBSA-N
XLogP1.94
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazol-1-yl]acetic acid
CID 99978642
1,3,5-trimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
CID 95566954
1-ethyl-3-methyl-5-[(2S)-pyrrolidin-2-yl]pyrazole
CID 42576240
5-chloro-1,3-dimethyl-4-[(2S)-pyrrolidin-2-yl]pyrazole
CID 95970426
4-bromo-1-ethyl-5-pyrrolidin-2-ylpyrazole
CID 114663184
2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine
CID 131382411
2-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]azepane
CID 113443139
3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]-1H-pyrazole
CID 96633250
1-ethyl-5-pyrrolidin-2-ylimidazole
CID 66134082
3-(3,5-dimethyl-1-propylpyrazol-4-yl)piperidine
CID 105478412
(2R)-2-(2-ethyl-1,2,4-triazol-3-yl)piperidine
CID 94552945
2-chloro-4,6-dimethyl-5-piperidin-2-ylpyrimidine
CID 115070130

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole?
The IUPAC name of 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole (CID 99978633) is 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole.
What is the SMILES notation for 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole?
The canonical SMILES for 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole is CCn1nc(C)c([C@H]2CCCN2)c1C.
What is the InChIKey of 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole?
The InChIKey is OWJVJDYZYPZIIQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-14-9(3)11(8(2)13-14)10-6-5-7-12-10/h10,12H,4-7H2,1-3H3/t10-/m1/s1.
What are the key properties of 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole?
1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole has a molecular weight of 193.29 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole is sourced from PubChem (CID 99978633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).