N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide

C14H23F3N2O — CID 146322488

IUPACN-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
SMILESCCN1CCC(C)(NC(=O)C2(C(F)(F)F)CCC2)CC1
InChIInChI=1S/C14H23F3N2O/c1-3-19-9-7-12(2,8-10-19)18-11(20)13(5-4-6-13)14(15,16)17/h3-10H2,1-2H3,(H,18,20)
InChIKeyNALMERVDSPYWTG-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.71
Rot. Bonds3

About N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide

N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide (PubChem CID 146322488) has the molecular formula C14H23F3N2O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
PubChem CID146322488
Molecular FormulaC14H23F3N2O
Molecular Weight292.34 g/mol
Exact Mass292.18
IUPAC NameN-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
SMILESCCN1CCC(C)(NC(=O)C2(C(F)(F)F)CCC2)CC1
InChIInChI=1S/C14H23F3N2O/c1-3-19-9-7-12(2,8-10-19)18-11(20)13(5-4-6-13)14(15,16)17/h3-10H2,1-2H3,(H,18,20)
InChIKeyNALMERVDSPYWTG-UHFFFAOYSA-N
XLogP2.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(3,3-dimethylbutyl)-4-fluoropiperidin-4-yl]methyl]-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 16005577
N-[2-(4-methylpiperidin-1-yl)ethyl]-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 123475510
N-[2-[4-(methylaminomethyl)piperidin-1-yl]ethyl]-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 134423032
N-(1,4-dimethylpiperidin-4-yl)-3,3,3-trifluoropropanamide
CID 134435194
N-(1,4-dimethylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 134435830
3,3,3-trifluoro-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)propanamide
CID 134505506
N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 134505560
1-[4-(2,2-Difluoropropylamino)piperidin-1-yl]-3,3-dimethylbutan-1-one
CID 140912257
N-(1,4-dimethylpiperidin-4-yl)-3,3,3-trifluoropropanamide;ethane
CID 142327102
[(3R)-3-ethylpiperazin-1-yl]-[1-(trifluoromethyl)cyclobutyl]methanone
CID 156695491
N-(1-ethyl-4-methylpiperidin-4-yl)-3,3,3-trifluoropropanamide
CID 169831902
N,1-ditert-butyl-3,3-difluoropiperidine-4-carboxamide
CID 171406675

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
The IUPAC name of N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide (CID 146322488) is N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide.
What is the SMILES notation for N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
The canonical SMILES for N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide is CCN1CCC(C)(NC(=O)C2(C(F)(F)F)CCC2)CC1.
What is the InChIKey of N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
The InChIKey is NALMERVDSPYWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O/c1-3-19-9-7-12(2,8-10-19)18-11(20)13(5-4-6-13)14(15,16)17/h3-10H2,1-2H3,(H,18,20).
What are the key properties of N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-4-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 146322488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).