N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide

C15H22N4O2 — CID 91917776

IUPACN-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide
SMILESCCn1ccc(C(=O)N2CCC(CC(=O)NC3CC3)C2)n1
InChIInChI=1S/C15H22N4O2/c1-2-19-8-6-13(17-19)15(21)18-7-5-11(10-18)9-14(20)16-12-3-4-12/h6,8,11-12H,2-5,7,9-10H2,1H3,(H,16,20)
InChIKeyDLQNEFMZAPAZKQ-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.03
Rot. Bonds5

About N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide

N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide (PubChem CID 91917776) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide
PubChem CID91917776
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide
SMILESCCn1ccc(C(=O)N2CCC(CC(=O)NC3CC3)C2)n1
InChIInChI=1S/C15H22N4O2/c1-2-19-8-6-13(17-19)15(21)18-7-5-11(10-18)9-14(20)16-12-3-4-12/h6,8,11-12H,2-5,7,9-10H2,1H3,(H,16,20)
InChIKeyDLQNEFMZAPAZKQ-UHFFFAOYSA-N
XLogP1.03
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide (CID 91917776) is N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide is CCn1ccc(C(=O)N2CCC(CC(=O)NC3CC3)C2)n1.
What is the InChIKey of N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide?
The InChIKey is DLQNEFMZAPAZKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-2-19-8-6-13(17-19)15(21)18-7-5-11(10-18)9-14(20)16-12-3-4-12/h6,8,11-12H,2-5,7,9-10H2,1H3,(H,16,20).
What are the key properties of N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide?
N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide has a molecular weight of 290.37 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(1-ethylpyrazole-3-carbonyl)pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 91917776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).