3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide

C15H28N2O3 — CID 71867494

IUPAC3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide
SMILESCOC1(C)CC(NC(=O)N2CCCC(CO)C2)C1(C)C
InChIInChI=1S/C15H28N2O3/c1-14(2)12(8-15(14,3)20-4)16-13(19)17-7-5-6-11(9-17)10-18/h11-12,18H,5-10H2,1-4H3,(H,16,19)
InChIKeyYZCMVAQEVZKXSO-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.60
Rot. Bonds3

About 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide

3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide (PubChem CID 71867494) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide
PubChem CID71867494
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide
SMILESCOC1(C)CC(NC(=O)N2CCCC(CO)C2)C1(C)C
InChIInChI=1S/C15H28N2O3/c1-14(2)12(8-15(14,3)20-4)16-13(19)17-7-5-6-11(9-17)10-18/h11-12,18H,5-10H2,1-4H3,(H,16,19)
InChIKeyYZCMVAQEVZKXSO-UHFFFAOYSA-N
XLogP1.60
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide?
The IUPAC name of 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide (CID 71867494) is 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide?
The canonical SMILES for 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide is COC1(C)CC(NC(=O)N2CCCC(CO)C2)C1(C)C.
What is the InChIKey of 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide?
The InChIKey is YZCMVAQEVZKXSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-14(2)12(8-15(14,3)20-4)16-13(19)17-7-5-6-11(9-17)10-18/h11-12,18H,5-10H2,1-4H3,(H,16,19).
What are the key properties of 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide?
3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-N-(3-methoxy-2,2,3-trimethylcyclobutyl)piperidine-1-carboxamide is sourced from PubChem (CID 71867494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).