N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide

C15H25F3N2O — CID 114428415

IUPACN-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N(CC(F)(F)F)C(C)C2CC2)C1
InChIInChI=1S/C15H25F3N2O/c1-3-11-6-7-19-13(8-11)14(21)20(9-15(16,17)18)10(2)12-4-5-12/h10-13,19H,3-9H2,1-2H3
InChIKeyMCKUTPWIXLUBGF-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.95
Rot. Bonds5

About N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide

N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide (PubChem CID 114428415) has the molecular formula C15H25F3N2O and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
PubChem CID114428415
Molecular FormulaC15H25F3N2O
Molecular Weight306.37 g/mol
Exact Mass306.19
IUPAC NameN-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N(CC(F)(F)F)C(C)C2CC2)C1
InChIInChI=1S/C15H25F3N2O/c1-3-11-6-7-19-13(8-11)14(21)20(9-15(16,17)18)10(2)12-4-5-12/h10-13,19H,3-9H2,1-2H3
InChIKeyMCKUTPWIXLUBGF-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 114428482
N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 54870149
N-butan-2-yl-N,4-diethylpiperidine-2-carboxamide
CID 114428039
2-[(4-ethylpiperidine-2-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 114429250
N-[1-(dimethylamino)propan-2-yl]-N,4-diethylpiperidine-2-carboxamide
CID 103188614
2-amino-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 55036006
4-ethyl-N-methyl-N-(4-methylpentan-2-yl)piperidine-2-carboxamide
CID 114428433
(3S)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 81129178
N-(1-cyclopropylethyl)-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 60717510
N,N-dibutyl-4-ethylpiperidine-2-carboxamide
CID 114428005
2-amino-N-(1-cyclopropylethyl)-2-ethyl-N-(2,2,2-trifluoroethyl)butanamide
CID 79809276
N-(1-cyclopropylethyl)-4-(methylamino)-N-(2,2,2-trifluoroethyl)oxolane-3-carboxamide
CID 66267387

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The IUPAC name of N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide (CID 114428415) is N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The canonical SMILES for N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)N(CC(F)(F)F)C(C)C2CC2)C1.
What is the InChIKey of N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The InChIKey is MCKUTPWIXLUBGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O/c1-3-11-6-7-19-13(8-11)14(21)20(9-15(16,17)18)10(2)12-4-5-12/h10-13,19H,3-9H2,1-2H3.
What are the key properties of N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-4-ethyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114428415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).