4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide

C14H26N2O2 — CID 114629713

IUPAC4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC2CC(O)C2(C)C)C1
InChIInChI=1S/C14H26N2O2/c1-4-9-5-6-15-10(7-9)13(18)16-11-8-12(17)14(11,2)3/h9-12,15,17H,4-8H2,1-3H3,(H,16,18)
InChIKeyRDCSOMKZZPTACK-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.04
Rot. Bonds3

About 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide

4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide (PubChem CID 114629713) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide
PubChem CID114629713
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC2CC(O)C2(C)C)C1
InChIInChI=1S/C14H26N2O2/c1-4-9-5-6-15-10(7-9)13(18)16-11-8-12(17)14(11,2)3/h9-12,15,17H,4-8H2,1-3H3,(H,16,18)
InChIKeyRDCSOMKZZPTACK-UHFFFAOYSA-N
XLogP1.04
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide (CID 114629713) is 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)NC2CC(O)C2(C)C)C1.
What is the InChIKey of 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide?
The InChIKey is RDCSOMKZZPTACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-4-9-5-6-15-10(7-9)13(18)16-11-8-12(17)14(11,2)3/h9-12,15,17H,4-8H2,1-3H3,(H,16,18).
What are the key properties of 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide?
4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.04, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide is sourced from PubChem (CID 114629713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).