N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide

C20H24N4O2 — CID 5330950

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide
SMILESCC(C(=O)Nc1cc(C2CC2)[nH]n1)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C20H24N4O2/c1-13(20(26)21-18-12-17(22-23-18)15-5-6-15)14-7-9-16(10-8-14)24-11-3-2-4-19(24)25/h7-10,12-13,15H,2-6,11H2,1H3,(H2,21,22,23,26)
InChIKeyRHIXMWQQSAONBY-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.55
Rot. Bonds5

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide (PubChem CID 5330950) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide
PubChem CID5330950
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide
SMILESCC(C(=O)Nc1cc(C2CC2)[nH]n1)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C20H24N4O2/c1-13(20(26)21-18-12-17(22-23-18)15-5-6-15)14-7-9-16(10-8-14)24-11-3-2-4-19(24)25/h7-10,12-13,15H,2-6,11H2,1H3,(H2,21,22,23,26)
InChIKeyRHIXMWQQSAONBY-UHFFFAOYSA-N
XLogP3.55
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide (CID 5330950) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide is CC(C(=O)Nc1cc(C2CC2)[nH]n1)c1ccc(N2CCCCC2=O)cc1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide?
The InChIKey is RHIXMWQQSAONBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-13(20(26)21-18-12-17(22-23-18)15-5-6-15)14-7-9-16(10-8-14)24-11-3-2-4-19(24)25/h7-10,12-13,15H,2-6,11H2,1H3,(H2,21,22,23,26).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide has a molecular weight of 352.44 g/mol, XLogP of 3.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide is sourced from PubChem (CID 5330950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).