N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide

C15H28N2O2 — CID 99775471

IUPACN-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide
SMILESCC(C)(O)CCN1CCC(NC(=O)C2CCC2)CC1
InChIInChI=1S/C15H28N2O2/c1-15(2,19)8-11-17-9-6-13(7-10-17)16-14(18)12-4-3-5-12/h12-13,19H,3-11H2,1-2H3,(H,16,18)
InChIKeyHJAMRPHXIHEJSH-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.53
Rot. Bonds5

About N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide

N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide (PubChem CID 99775471) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide
PubChem CID99775471
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide
SMILESCC(C)(O)CCN1CCC(NC(=O)C2CCC2)CC1
InChIInChI=1S/C15H28N2O2/c1-15(2,19)8-11-17-9-6-13(7-10-17)16-14(18)12-4-3-5-12/h12-13,19H,3-11H2,1-2H3,(H,16,18)
InChIKeyHJAMRPHXIHEJSH-UHFFFAOYSA-N
XLogP1.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 165434516
1-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]ethanone
CID 79355582
1-(2-aminoethyl)-N-cyclobutylpiperidine-4-carboxamide
CID 115161796
N-[1-(2-methylprop-2-enyl)piperidin-4-yl]cyclohexanecarboxamide
CID 86860914
2-methyl-4-(4-methylpiperidin-1-yl)butan-2-ol
CID 79316334
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110822231
N-cyclohexyl-1-(2-piperidin-4-ylethyl)piperidine-4-carboxamide
CID 67801916
N-cyclopentylcyclobutanecarboxamide
CID 21158774
3-amino-N-[1-(2-methoxyethyl)piperidin-4-yl]cyclohexane-1-carboxamide;dihydrochloride
CID 119861345
methyl 1-(3-hydroxy-3-methylbutyl)pyrrolidine-3-carboxylate
CID 79823137
N-[1-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]piperidin-4-yl]cyclohexanecarboxamide
CID 86860953
N-(1-benzylpiperidin-4-yl)cyclobutanecarboxamide
CID 2729529

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide?
The IUPAC name of N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide (CID 99775471) is N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide is CC(C)(O)CCN1CCC(NC(=O)C2CCC2)CC1.
What is the InChIKey of N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide?
The InChIKey is HJAMRPHXIHEJSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-15(2,19)8-11-17-9-6-13(7-10-17)16-14(18)12-4-3-5-12/h12-13,19H,3-11H2,1-2H3,(H,16,18).
What are the key properties of N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide?
N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-hydroxy-3-methylbutyl)piperidin-4-yl]cyclobutanecarboxamide is sourced from PubChem (CID 99775471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).