1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one

C16H24N6O2 — CID 126946217

IUPAC1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one
SMILESCN1CCCC(N2CC(n3cc(N4CCN(C)C4=O)cn3)C2)C1=O
InChIInChI=1S/C16H24N6O2/c1-18-5-3-4-14(15(18)23)20-9-13(10-20)22-11-12(8-17-22)21-7-6-19(2)16(21)24/h8,11,13-14H,3-7,9-10H2,1-2H3
InChIKeyPNGVFPDKCHBPHF-UHFFFAOYSA-N
MW332.41 g/mol
LogP0.23
Rot. Bonds3

About 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one

1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one (PubChem CID 126946217) has the molecular formula C16H24N6O2 and a molecular weight of 332.41 g/mol. Its IUPAC name is 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one.

Molecular Properties

Compound Name1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one
PubChem CID126946217
Molecular FormulaC16H24N6O2
Molecular Weight332.41 g/mol
Exact Mass332.20
IUPAC Name1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one
SMILESCN1CCCC(N2CC(n3cc(N4CCN(C)C4=O)cn3)C2)C1=O
InChIInChI=1S/C16H24N6O2/c1-18-5-3-4-14(15(18)23)20-9-13(10-20)22-11-12(8-17-22)21-7-6-19(2)16(21)24/h8,11,13-14H,3-7,9-10H2,1-2H3
InChIKeyPNGVFPDKCHBPHF-UHFFFAOYSA-N
XLogP0.23
TPSA64.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 50.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(1-cyclohexylazetidin-3-yl)pyrazol-4-yl]-3-methylimidazolidin-2-one
CID 126946060
1-[1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazol-4-yl]-3-methylimidazolidin-2-one
CID 126946275
1-methyl-3-[1-[1-(2-piperidin-1-ylethyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126946062
N-cyclopentyl-3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidine-1-carboxamide
CID 126945976
1-methyl-3-[1-[1-[2-(1-methylpiperidin-2-yl)ethyl]azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126946203
6-[[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]methyl]piperidin-2-one
CID 126946131
1-methyl-3-[1-[1-(oxan-3-ylmethyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126946224
1-[1-[1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyrrolidin-3-yl]pyrazol-4-yl]-3-methylimidazolidin-2-one
CID 126948793
1-methyl-3-[1-[1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126946288
1-[1-[1-(5-bromothiophene-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]-3-methylimidazolidin-2-one
CID 126946284
1-methyl-3-[1-[1-[(5-methylpyrazin-2-yl)methyl]azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126946140
1-methyl-3-[1-[1-(5-methylpyrazin-2-yl)pyrrolidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126948796

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one?
The IUPAC name of 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one (CID 126946217) is 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one.
What is the SMILES notation for 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one?
The canonical SMILES for 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one is CN1CCCC(N2CC(n3cc(N4CCN(C)C4=O)cn3)C2)C1=O.
What is the InChIKey of 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one?
The InChIKey is PNGVFPDKCHBPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O2/c1-18-5-3-4-14(15(18)23)20-9-13(10-20)22-11-12(8-17-22)21-7-6-19(2)16(21)24/h8,11,13-14H,3-7,9-10H2,1-2H3.
What are the key properties of 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one?
1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one has a molecular weight of 332.41 g/mol, XLogP of 0.23, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]piperidin-2-one is sourced from PubChem (CID 126946217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).