1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine

C10H21FN2O — CID 71188956

IUPAC1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine
SMILESCOCCN1CCN(C[C@H](C)F)CC1
InChIInChI=1S/C10H21FN2O/c1-10(11)9-13-5-3-12(4-6-13)7-8-14-2/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyHNWRMZRTQNBJND-JTQLQIEISA-N
MW204.29 g/mol
LogP0.61
Rot. Bonds5

About 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine

1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine (PubChem CID 71188956) has the molecular formula C10H21FN2O and a molecular weight of 204.29 g/mol. Its IUPAC name is 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine.

Molecular Properties

Compound Name1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine
PubChem CID71188956
Molecular FormulaC10H21FN2O
Molecular Weight204.29 g/mol
Exact Mass204.16
IUPAC Name1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine
SMILESCOCCN1CCN(C[C@H](C)F)CC1
InChIInChI=1S/C10H21FN2O/c1-10(11)9-13-5-3-12(4-6-13)7-8-14-2/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyHNWRMZRTQNBJND-JTQLQIEISA-N
XLogP0.61
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine?
The IUPAC name of 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine (CID 71188956) is 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine.
What is the SMILES notation for 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine?
The canonical SMILES for 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine is COCCN1CCN(C[C@H](C)F)CC1.
What is the InChIKey of 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine?
The InChIKey is HNWRMZRTQNBJND-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21FN2O/c1-10(11)9-13-5-3-12(4-6-13)7-8-14-2/h10H,3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine?
1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine has a molecular weight of 204.29 g/mol, XLogP of 0.61, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-fluoropropyl]-4-(2-methoxyethyl)piperazine is sourced from PubChem (CID 71188956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).