1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine

C10H19FN2 — CID 130668663

IUPAC1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine
SMILESCCN1CCN(CC2(F)CC2)CC1
InChIInChI=1S/C10H19FN2/c1-2-12-5-7-13(8-6-12)9-10(11)3-4-10/h2-9H2,1H3
InChIKeyJWMHWLHNLAURPN-UHFFFAOYSA-N
MW186.27 g/mol
LogP1.13
Rot. Bonds3

About 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine

1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine (PubChem CID 130668663) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine.

Molecular Properties

Compound Name1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine
PubChem CID130668663
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine
SMILESCCN1CCN(CC2(F)CC2)CC1
InChIInChI=1S/C10H19FN2/c1-2-12-5-7-13(8-6-12)9-10(11)3-4-10/h2-9H2,1H3
InChIKeyJWMHWLHNLAURPN-UHFFFAOYSA-N
XLogP1.13
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine with MolForge

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

Launch Full Analysis

Related Compounds

1-ethyl-4-fluoro-4-[(4-methylpiperidin-1-yl)methyl]piperidine
CID 176561897
1-[(1-fluorocyclopropyl)methyl]-4-methyl-1,4-diazepane
CID 131201174
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1-[1-[(1-fluorocyclopropyl)methyl]piperidin-4-yl]ethanamine
CID 130905098
1,4-diethylpiperazine;sulfane
CID 177062456
1-ethyl-5,5-difluoroazocane
CID 162614940
1-ethyl-4-fluoro-4-iodopiperidine
CID 147786451
1-[(1-fluorocyclopropyl)methyl]-4-methylazepane
CID 130667715
1-[(4-ethylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 60723383
1-[(1-fluorocyclopropyl)methyl]-3-methylpyrrolidine
CID 130727528
3,9-diethyl-3,9-diazaspiro[5.5]undecane
CID 20622591
1-ethyl-4-fluoropiperidine-4-carboxylic acid;hydrochloride
CID 90079651

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine?
The IUPAC name of 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine (CID 130668663) is 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine.
What is the SMILES notation for 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine?
The canonical SMILES for 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine is CCN1CCN(CC2(F)CC2)CC1.
What is the InChIKey of 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine?
The InChIKey is JWMHWLHNLAURPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c1-2-12-5-7-13(8-6-12)9-10(11)3-4-10/h2-9H2,1H3.
What are the key properties of 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine?
1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine has a molecular weight of 186.27 g/mol, XLogP of 1.13, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine is sourced from PubChem (CID 130668663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).