N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide

C15H25F3N4O2 — CID 75894562

IUPACN-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide
SMILESCNC(=O)CN1CCC(NC(=O)N2CCCC(C(F)(F)F)C2)CC1
InChIInChI=1S/C15H25F3N4O2/c1-19-13(23)10-21-7-4-12(5-8-21)20-14(24)22-6-2-3-11(9-22)15(16,17)18/h11-12H,2-10H2,1H3,(H,19,23)(H,20,24)
InChIKeyFMXGHKLNASYUMF-UHFFFAOYSA-N
MW350.39 g/mol
LogP1.18
Rot. Bonds3

About N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide

N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide (PubChem CID 75894562) has the molecular formula C15H25F3N4O2 and a molecular weight of 350.39 g/mol. Its IUPAC name is N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide
PubChem CID75894562
Molecular FormulaC15H25F3N4O2
Molecular Weight350.39 g/mol
Exact Mass350.19
IUPAC NameN-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide
SMILESCNC(=O)CN1CCC(NC(=O)N2CCCC(C(F)(F)F)C2)CC1
InChIInChI=1S/C15H25F3N4O2/c1-19-13(23)10-21-7-4-12(5-8-21)20-14(24)22-6-2-3-11(9-22)15(16,17)18/h11-12H,2-10H2,1H3,(H,19,23)(H,20,24)
InChIKeyFMXGHKLNASYUMF-UHFFFAOYSA-N
XLogP1.18
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.39
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)pyrrolidine-1-carboxamide
CID 119044269
(2R,6R)-2,6-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]morpholine-4-carboxamide
CID 95287047
N-methyl-2-[(3S)-3-(methylamino)pyrrolidin-1-yl]acetamide
CID 170394930
N-(2-methylcyclopropyl)-3-(trifluoromethyl)piperidine-1-carboxamide
CID 56825754
(3R)-N-[(1R,2R)-2-methylcyclopropyl]-3-(trifluoromethyl)piperidine-1-carboxamide
CID 100844708
2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
CID 60751395
3-methyl-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]piperidine-1-carboxamide
CID 60606505
N-(1-benzylpiperidin-4-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 45281619
2-[ethyl-[3-[[3-(trifluoromethyl)piperidine-1-carbonyl]amino]cyclobutyl]amino]acetic acid
CID 122025951
2-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]acetamide
CID 43704790
N-(cyclohexylcarbamoyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119905800
1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one
CID 60655671

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide?
The IUPAC name of N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide (CID 75894562) is N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide?
The canonical SMILES for N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide is CNC(=O)CN1CCC(NC(=O)N2CCCC(C(F)(F)F)C2)CC1.
What is the InChIKey of N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide?
The InChIKey is FMXGHKLNASYUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N4O2/c1-19-13(23)10-21-7-4-12(5-8-21)20-14(24)22-6-2-3-11(9-22)15(16,17)18/h11-12H,2-10H2,1H3,(H,19,23)(H,20,24).
What are the key properties of N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide?
N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide has a molecular weight of 350.39 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-(trifluoromethyl)piperidine-1-carboxamide is sourced from PubChem (CID 75894562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).