1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one

C15H21N5O2 — CID 154783908

IUPAC1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one
SMILESCN1CC(N2CC(C(=O)N3CCCc4[nH]ncc43)CC2=O)C1
InChIInChI=1S/C15H21N5O2/c1-18-8-11(9-18)20-7-10(5-14(20)21)15(22)19-4-2-3-12-13(19)6-16-17-12/h6,10-11H,2-5,7-9H2,1H3,(H,16,17)
InChIKeyIPMHHUUNFGQXMC-UHFFFAOYSA-N
MW303.37 g/mol
LogP-0.15
Rot. Bonds2

About 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one

1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one (PubChem CID 154783908) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one
PubChem CID154783908
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one
SMILESCN1CC(N2CC(C(=O)N3CCCc4[nH]ncc43)CC2=O)C1
InChIInChI=1S/C15H21N5O2/c1-18-8-11(9-18)20-7-10(5-14(20)21)15(22)19-4-2-3-12-13(19)6-16-17-12/h6,10-11H,2-5,7-9H2,1H3,(H,16,17)
InChIKeyIPMHHUUNFGQXMC-UHFFFAOYSA-N
XLogP-0.15
TPSA72.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one?
The IUPAC name of 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one (CID 154783908) is 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one?
The canonical SMILES for 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one is CN1CC(N2CC(C(=O)N3CCCc4[nH]ncc43)CC2=O)C1.
What is the InChIKey of 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one?
The InChIKey is IPMHHUUNFGQXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-18-8-11(9-18)20-7-10(5-14(20)21)15(22)19-4-2-3-12-13(19)6-16-17-12/h6,10-11H,2-5,7-9H2,1H3,(H,16,17).
What are the key properties of 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one?
1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one has a molecular weight of 303.37 g/mol, XLogP of -0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylazetidin-3-yl)-4-(1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 154783908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).