2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

C10H18F3N3O — CID 79328008

IUPAC2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(CC(F)(F)F)C(=O)CN1CCC(N)CC1
InChIInChI=1S/C10H18F3N3O/c1-15(7-10(11,12)13)9(17)6-16-4-2-8(14)3-5-16/h8H,2-7,14H2,1H3
InChIKeyAGMRIVXHRYDSCR-UHFFFAOYSA-N
MW253.27 g/mol
LogP0.43
Rot. Bonds3

About 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 79328008) has the molecular formula C10H18F3N3O and a molecular weight of 253.27 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID79328008
Molecular FormulaC10H18F3N3O
Molecular Weight253.27 g/mol
Exact Mass253.14
IUPAC Name2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(CC(F)(F)F)C(=O)CN1CCC(N)CC1
InChIInChI=1S/C10H18F3N3O/c1-15(7-10(11,12)13)9(17)6-16-4-2-8(14)3-5-16/h8H,2-7,14H2,1H3
InChIKeyAGMRIVXHRYDSCR-UHFFFAOYSA-N
XLogP0.43
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(S)-2,3-Diamino-1-piperidin-1-yl-propan-1-one
CID 10012350
2,3-Diamino-1-piperidin-1-yl-propan-1-one
CID 11819467
2-Amino-1-(piperidin-1-yl)propan-1-one
CID 3152952
2-(4-aminopiperidin-1-yl)-N-methylacetamide
CID 18071178
2-Amino-1-(piperidin-1-yl)butan-1-one
CID 12742483
N-cyclopentyl-N-methyl-2-piperazin-1-ylacetamide
CID 43267406
2-(4-Aminopiperidin-1-YL)-N,N-diethylacetamide
CID 16770474
2-(4-Aminopiperidin-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one
CID 16777276
2-Amino-1-(1-piperidinyl)-1-propanone hydrochloride
CID 53444445
2-(4-aminopiperidin-1-yl)-N,N-dimethylacetamide
CID 16774281
2-amino-N-(1-methyl-piperidin-4-yl)-acetamide
CID 43373582
(2S)-2-amino-1-(piperidin-1-yl)propan-1-one hydrochloride
CID 50988046

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (CID 79328008) is 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is CN(CC(F)(F)F)C(=O)CN1CCC(N)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is AGMRIVXHRYDSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N3O/c1-15(7-10(11,12)13)9(17)6-16-4-2-8(14)3-5-16/h8H,2-7,14H2,1H3.
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 253.27 g/mol, XLogP of 0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 79328008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).