5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine

C15H20F2N2 — CID 64859705

IUPAC5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine
SMILESCC1CNC(C2CC2)CN1Cc1ccc(F)cc1F
InChIInChI=1S/C15H20F2N2/c1-10-7-18-15(11-2-3-11)9-19(10)8-12-4-5-13(16)6-14(12)17/h4-6,10-11,15,18H,2-3,7-9H2,1H3
InChIKeyDFXBJGWBUZYPKZ-UHFFFAOYSA-N
MW266.33 g/mol
LogP2.54
Rot. Bonds3

About 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine

5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine (PubChem CID 64859705) has the molecular formula C15H20F2N2 and a molecular weight of 266.33 g/mol. Its IUPAC name is 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine
PubChem CID64859705
Molecular FormulaC15H20F2N2
Molecular Weight266.33 g/mol
Exact Mass266.16
IUPAC Name5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine
SMILESCC1CNC(C2CC2)CN1Cc1ccc(F)cc1F
InChIInChI=1S/C15H20F2N2/c1-10-7-18-15(11-2-3-11)9-19(10)8-12-4-5-13(16)6-14(12)17/h4-6,10-11,15,18H,2-3,7-9H2,1H3
InChIKeyDFXBJGWBUZYPKZ-UHFFFAOYSA-N
XLogP2.54
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2,4-difluorophenyl)methyl]-2-methyl-5-propan-2-ylpiperazine
CID 64833514
2-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-5-methylpiperazine
CID 64844702
1-[(4-chloro-2-fluorophenyl)methyl]-5-cyclopropyl-2-ethylpiperazine
CID 114860665
5-cyclopropyl-1-[(2,5-difluorophenyl)methyl]-2-propan-2-ylpiperazine
CID 64861649
3-cyclopropyl-1-[(2,4-difluorophenyl)methyl]piperazine
CID 64832815
5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2,2-dimethylpiperazine
CID 64861102
(2S)-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine
CID 82713388
5-cyclopropyl-2-methyl-1-(naphthalen-1-ylmethyl)piperazine
CID 64860475
3-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-1,4-diazepane
CID 64869739
5-cyclopropyl-2-ethyl-1-[(5-fluoro-2-methylphenyl)methyl]piperazine
CID 105375742
5-cyclopropyl-1-[(5-fluoro-2-methylphenyl)methyl]-2-propan-2-ylpiperazine
CID 105375744
5-cyclopropyl-2-methyl-1-(pyridin-4-ylmethyl)piperazine
CID 64860864

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine?
The IUPAC name of 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine (CID 64859705) is 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine is CC1CNC(C2CC2)CN1Cc1ccc(F)cc1F.
What is the InChIKey of 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine?
The InChIKey is DFXBJGWBUZYPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2/c1-10-7-18-15(11-2-3-11)9-19(10)8-12-4-5-13(16)6-14(12)17/h4-6,10-11,15,18H,2-3,7-9H2,1H3.
What are the key properties of 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine?
5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine has a molecular weight of 266.33 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-[(2,4-difluorophenyl)methyl]-2-methylpiperazine is sourced from PubChem (CID 64859705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).