(2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid

C10H19F3N2O2 — CID 135347784

IUPAC(2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid
SMILESCC(C)N1CCNC[C@H]1C.O=C(O)C(F)(F)F
InChIInChI=1S/C8H18N2.C2HF3O2/c1-7(2)10-5-4-9-6-8(10)3;3-2(4,5)1(6)7/h7-9H,4-6H2,1-3H3;(H,6,7)/t8-;/m1./s1
InChIKeySUCQRCDKDXFLER-DDWIOCJRSA-N
MW256.27 g/mol
LogP1.32
Rot. Bonds1

About (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid

(2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid (PubChem CID 135347784) has the molecular formula C10H19F3N2O2 and a molecular weight of 256.27 g/mol. Its IUPAC name is (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name(2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid
PubChem CID135347784
Molecular FormulaC10H19F3N2O2
Molecular Weight256.27 g/mol
Exact Mass256.14
IUPAC Name(2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid
SMILESCC(C)N1CCNC[C@H]1C.O=C(O)C(F)(F)F
InChIInChI=1S/C8H18N2.C2HF3O2/c1-7(2)10-5-4-9-6-8(10)3;3-2(4,5)1(6)7/h7-9H,4-6H2,1-3H3;(H,6,7)/t8-;/m1./s1
InChIKeySUCQRCDKDXFLER-DDWIOCJRSA-N
XLogP1.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-methyl-1-propan-2-ylpiperazine;dihydrochloride
CID 57463733
2-methyl-1-[(2S)-2-methylpiperazin-1-yl]propan-1-one;2,2,2-trifluoroacetic acid
CID 172777636
2,2,2-trifluoroacetic acid;(2S)-N,N,2-trimethylpiperazine-1-carboxamide
CID 175748741
(2R)-1-ethyl-2-methylpiperazine;2,2,2-trifluoroacetic acid
CID 146455396
3-[(2S)-2-methylpiperazin-1-yl]butanoic acid
CID 82755213
2-methyl-3-[(2R)-2-methylpiperazin-1-yl]butanoic acid
CID 82761791
2-methyl-1-propylpiperazine;2,2,2-trifluoroacetic acid
CID 174972322
(2R)-1-(cyclopropylmethyl)-2-methylpiperazine;2,2,2-trifluoroacetic acid
CID 172731821
N-methyl-2-[(2R)-2-methylpiperazin-1-yl]propanamide
CID 82761351
2-(2-methylpiperazin-1-yl)butanoic acid
CID 64663395
2-[(2R)-2-methylpiperazin-1-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 82755930
(3R)-N-propan-2-ylpyrrolidin-3-amine;bis(2,2,2-trifluoroacetic acid)
CID 86642075

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid?
The IUPAC name of (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid (CID 135347784) is (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid.
What is the SMILES notation for (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid?
The canonical SMILES for (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid is CC(C)N1CCNC[C@H]1C.O=C(O)C(F)(F)F.
What is the InChIKey of (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid?
The InChIKey is SUCQRCDKDXFLER-DDWIOCJRSA-N. The full InChI is InChI=1S/C8H18N2.C2HF3O2/c1-7(2)10-5-4-9-6-8(10)3;3-2(4,5)1(6)7/h7-9H,4-6H2,1-3H3;(H,6,7)/t8-;/m1./s1.
What are the key properties of (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid?
(2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid has a molecular weight of 256.27 g/mol, XLogP of 1.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-propan-2-ylpiperazine;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 135347784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).