(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide

C18H26F3N3O2 — CID 124810432

IUPAC(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
SMILESC[C@@H](OCC(F)(F)F)C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1
InChIInChI=1S/C18H26F3N3O2/c1-14(26-13-18(19,20)21)17(25)22-8-9-24-11-10-23(2)12-16(24)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,22,25)/t14-,16+/m1/s1
InChIKeyNSYBLNQPKDYRCU-ZBFHGGJFSA-N
MW373.42 g/mol
LogP2.06
Rot. Bonds7

About (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide

(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide (PubChem CID 124810432) has the molecular formula C18H26F3N3O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
PubChem CID124810432
Molecular FormulaC18H26F3N3O2
Molecular Weight373.42 g/mol
Exact Mass373.20
IUPAC Name(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
SMILESC[C@@H](OCC(F)(F)F)C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1
InChIInChI=1S/C18H26F3N3O2/c1-14(26-13-18(19,20)21)17(25)22-8-9-24-11-10-23(2)12-16(24)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,22,25)/t14-,16+/m1/s1
InChIKeyNSYBLNQPKDYRCU-ZBFHGGJFSA-N
XLogP2.06
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide with MolForge

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Related Compounds

N-[2-[(2S)-4-methyl-2-phenylpiperazin-1-yl]ethyl]cyclobutanecarboxamide
CID 33403212
methyl 4-(4-methyl-2-phenylpiperazin-1-yl)butanoate
CID 43377701
5-acetyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]thiophene-2-carboxamide
CID 42958850
(2R)-N-[3-[(2R)-4-methyl-2-phenylpiperazin-1-yl]propyl]-2-phenylbutanamide
CID 124813932
2-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]furan-3-carboxamide
CID 47028501
N-[2-[(2S)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-6-[(1R)-1-phenylethoxy]pyridine-3-carboxamide
CID 95307862
2-(2-methoxyphenyl)-N-[3-[(2S)-4-methyl-2-phenylpiperazin-1-yl]propyl]acetamide
CID 37295525
(2S)-2-[(2-fluorophenyl)sulfonylamino]-N-[3-(4-methyl-2-phenylpiperazin-1-yl)propyl]propanamide
CID 55938683
3,3-dimethyl-1-(4-methyl-2-phenylpiperazin-1-yl)butan-2-one
CID 43229060
1-(3-chlorophenyl)-3-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]urea
CID 43063800
(2R)-1-(4-methyl-2-phenylpiperazin-1-yl)propan-2-ol
CID 113354637
2,2-difluoro-N-[3-[(2R)-4-methyl-2-phenylpiperazin-1-yl]propyl]-3-morpholin-4-yl-3-oxopropanamide
CID 124885878

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The IUPAC name of (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide (CID 124810432) is (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide.
What is the SMILES notation for (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The canonical SMILES for (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide is C[C@@H](OCC(F)(F)F)C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1.
What is the InChIKey of (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The InChIKey is NSYBLNQPKDYRCU-ZBFHGGJFSA-N. The full InChI is InChI=1S/C18H26F3N3O2/c1-14(26-13-18(19,20)21)17(25)22-8-9-24-11-10-23(2)12-16(24)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,22,25)/t14-,16+/m1/s1.
What are the key properties of (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
(2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide has a molecular weight of 373.42 g/mol, XLogP of 2.06, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]ethyl]-2-(2,2,2-trifluoroethoxy)propanamide is sourced from PubChem (CID 124810432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).