N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide

C14H23F3N2O — CID 107413534

IUPACN-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCC1CCC(CNC(=O)C2CCC(C(F)(F)F)CN2)C1
InChIInChI=1S/C14H23F3N2O/c1-9-2-3-10(6-9)7-19-13(20)12-5-4-11(8-18-12)14(15,16)17/h9-12,18H,2-8H2,1H3,(H,19,20)
InChIKeyWEWDNYDBAYDXSL-UHFFFAOYSA-N
MW292.35 g/mol
LogP2.47
Rot. Bonds3

About N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide

N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide (PubChem CID 107413534) has the molecular formula C14H23F3N2O and a molecular weight of 292.35 g/mol. Its IUPAC name is N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide
PubChem CID107413534
Molecular FormulaC14H23F3N2O
Molecular Weight292.35 g/mol
Exact Mass292.18
IUPAC NameN-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCC1CCC(CNC(=O)C2CCC(C(F)(F)F)CN2)C1
InChIInChI=1S/C14H23F3N2O/c1-9-2-3-10(6-9)7-19-13(20)12-5-4-11(8-18-12)14(15,16)17/h9-12,18H,2-8H2,1H3,(H,19,20)
InChIKeyWEWDNYDBAYDXSL-UHFFFAOYSA-N
XLogP2.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 107413261
N-(2,2,3,3-tetrafluoropropyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 106293083
N-[(4-methylmorpholin-2-yl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908915
N-[3-(dimethylamino)-2,2-dimethylpropyl]-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908525
N-(3-ethylpentan-3-yl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908898
2,2,2-trifluoro-N-[(3-methylcyclopentyl)methyl]acetamide
CID 107415477
4-methoxy-N-[(3-methylcyclohexyl)methyl]pyrrolidine-2-carboxamide
CID 103832995
4-methyl-N-[(3-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114130671
N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908570
4-methyl-N-[(4-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114424006
N-(5-methylhexan-2-yl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908871
N-heptan-2-yl-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908717

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
The IUPAC name of N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide (CID 107413534) is N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
The canonical SMILES for N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide is CC1CCC(CNC(=O)C2CCC(C(F)(F)F)CN2)C1.
What is the InChIKey of N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
The InChIKey is WEWDNYDBAYDXSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O/c1-9-2-3-10(6-9)7-19-13(20)12-5-4-11(8-18-12)14(15,16)17/h9-12,18H,2-8H2,1H3,(H,19,20).
What are the key properties of N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide has a molecular weight of 292.35 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide is sourced from PubChem (CID 107413534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).