N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide

C13H24N2O2 — CID 104596944

IUPACN-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide
SMILESCN(CC1CC(O)C1)C(=O)C1(C)CCCCN1
InChIInChI=1S/C13H24N2O2/c1-13(5-3-4-6-14-13)12(17)15(2)9-10-7-11(16)8-10/h10-11,14,16H,3-9H2,1-2H3
InChIKeyCFBZIYNYVVQOOJ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.75
Rot. Bonds3

About N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide

N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide (PubChem CID 104596944) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide
PubChem CID104596944
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide
SMILESCN(CC1CC(O)C1)C(=O)C1(C)CCCCN1
InChIInChI=1S/C13H24N2O2/c1-13(5-3-4-6-14-13)12(17)15(2)9-10-7-11(16)8-10/h10-11,14,16H,3-9H2,1-2H3
InChIKeyCFBZIYNYVVQOOJ-UHFFFAOYSA-N
XLogP0.75
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-(oxan-2-ylmethyl)piperidine-2-carboxamide
CID 113368607
N,2-dimethyl-N-prop-2-ynylpiperidine-2-carboxamide
CID 104597142
N-(5-hydroxypentyl)-N,2-dimethylpiperidine-2-carboxamide
CID 107199154
1-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]-N-methylcyclobutane-1-carboxamide
CID 80598806
N-butan-2-yl-N,2-dimethylpiperidine-2-carboxamide
CID 104596127
N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide
CID 104596167
N-(2,2-difluoroethyl)-N,2-dimethylpyrrolidine-2-carboxamide
CID 115747592
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,2-dimethylpyrrolidine-2-carboxamide
CID 79314006
N-(1H-imidazol-2-ylmethyl)-N,2-dimethylpiperidine-2-carboxamide
CID 113430849
N-[(3-bromocyclobutyl)methyl]-N,1-dimethylcyclopentane-1-carboxamide
CID 80672586
N,N-bis(2-cyanoethyl)-2-methylpiperidine-2-carboxamide
CID 104596505
N,2-dimethyl-N-(thiophen-2-ylmethyl)piperidine-2-carboxamide
CID 113368557

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide?
The IUPAC name of N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide (CID 104596944) is N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide.
What is the SMILES notation for N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide?
The canonical SMILES for N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide is CN(CC1CC(O)C1)C(=O)C1(C)CCCCN1.
What is the InChIKey of N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide?
The InChIKey is CFBZIYNYVVQOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(5-3-4-6-14-13)12(17)15(2)9-10-7-11(16)8-10/h10-11,14,16H,3-9H2,1-2H3.
What are the key properties of N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide?
N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpiperidine-2-carboxamide is sourced from PubChem (CID 104596944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).