4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one

C18H26N2O2 — CID 138379715

IUPAC4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one
SMILESCC1(C)C(C(=O)N2CCC(c3cc[nH]c(=O)c3)CC2)C1(C)C
InChIInChI=1S/C18H26N2O2/c1-17(2)15(18(17,3)4)16(22)20-9-6-12(7-10-20)13-5-8-19-14(21)11-13/h5,8,11-12,15H,6-7,9-10H2,1-4H3,(H,19,21)
InChIKeyCGBYERJVUUSJRF-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.76
Rot. Bonds2

About 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one

4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one (PubChem CID 138379715) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one
PubChem CID138379715
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one
SMILESCC1(C)C(C(=O)N2CCC(c3cc[nH]c(=O)c3)CC2)C1(C)C
InChIInChI=1S/C18H26N2O2/c1-17(2)15(18(17,3)4)16(22)20-9-6-12(7-10-20)13-5-8-19-14(21)11-13/h5,8,11-12,15H,6-7,9-10H2,1-4H3,(H,19,21)
InChIKeyCGBYERJVUUSJRF-UHFFFAOYSA-N
XLogP2.76
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one?
The IUPAC name of 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one (CID 138379715) is 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one.
What is the SMILES notation for 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one?
The canonical SMILES for 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one is CC1(C)C(C(=O)N2CCC(c3cc[nH]c(=O)c3)CC2)C1(C)C.
What is the InChIKey of 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one?
The InChIKey is CGBYERJVUUSJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-17(2)15(18(17,3)4)16(22)20-9-6-12(7-10-20)13-5-8-19-14(21)11-13/h5,8,11-12,15H,6-7,9-10H2,1-4H3,(H,19,21).
What are the key properties of 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one?
4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one has a molecular weight of 302.42 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]-1H-pyridin-2-one is sourced from PubChem (CID 138379715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).