(4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one

C16H21N5O2 — CID 32647797

IUPAC(4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one
SMILESO=C([C@@H]1CC(=O)N(C2CC2)C1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C16H21N5O2/c22-15-9-12(11-21(15)13-1-2-13)16(23)20-7-5-19(6-8-20)14-10-17-3-4-18-14/h3-4,10,12-13H,1-2,5-9,11H2/t12-/m1/s1
InChIKeyLUZZENJGEYJHFE-GFCCVEGCSA-N
MW315.38 g/mol
LogP0.14
Rot. Bonds3

About (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one

(4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one (PubChem CID 32647797) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one
PubChem CID32647797
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name(4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one
SMILESO=C([C@@H]1CC(=O)N(C2CC2)C1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C16H21N5O2/c22-15-9-12(11-21(15)13-1-2-13)16(23)20-7-5-19(6-8-20)14-10-17-3-4-18-14/h3-4,10,12-13H,1-2,5-9,11H2/t12-/m1/s1
InChIKeyLUZZENJGEYJHFE-GFCCVEGCSA-N
XLogP0.14
TPSA69.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one?
The IUPAC name of (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one (CID 32647797) is (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one?
The canonical SMILES for (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one is O=C([C@@H]1CC(=O)N(C2CC2)C1)N1CCN(c2cnccn2)CC1.
What is the InChIKey of (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one?
The InChIKey is LUZZENJGEYJHFE-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H21N5O2/c22-15-9-12(11-21(15)13-1-2-13)16(23)20-7-5-19(6-8-20)14-10-17-3-4-18-14/h3-4,10,12-13H,1-2,5-9,11H2/t12-/m1/s1.
What are the key properties of (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one?
(4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one has a molecular weight of 315.38 g/mol, XLogP of 0.14, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-cyclopropyl-4-(4-pyrazin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 32647797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).