1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine

C16H31N3 — CID 64946348

IUPAC1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine
SMILESCCC1(CC)CN(C2CCN(C3CC3)C2)C(C)CN1
InChIInChI=1S/C16H31N3/c1-4-16(5-2)12-19(13(3)10-17-16)15-8-9-18(11-15)14-6-7-14/h13-15,17H,4-12H2,1-3H3
InChIKeyOERMPARCEUNZFX-UHFFFAOYSA-N
MW265.44 g/mol
LogP2.08
Rot. Bonds4

About 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine

1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine (PubChem CID 64946348) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine.

Molecular Properties

Compound Name1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine
PubChem CID64946348
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine
SMILESCCC1(CC)CN(C2CCN(C3CC3)C2)C(C)CN1
InChIInChI=1S/C16H31N3/c1-4-16(5-2)12-19(13(3)10-17-16)15-8-9-18(11-15)14-6-7-14/h13-15,17H,4-12H2,1-3H3
InChIKeyOERMPARCEUNZFX-UHFFFAOYSA-N
XLogP2.08
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclopropylpyrrolidin-3-yl)-5-ethyl-2,5-dimethylpiperazine
CID 64947502
1-cyclobutyl-5,5-diethyl-2-methylpiperazine
CID 64948334
3-(5,5-diethyl-2-methylpiperazin-1-yl)thiolane 1,1-dioxide
CID 64930017
5,5-diethyl-2-methyl-1-(2-methylcyclopropyl)piperazine
CID 64948522
5-tert-butyl-1-(1-cyclopropylpyrrolidin-3-yl)-2-methylpiperazine
CID 64946733
1-cycloheptyl-3,3-diethyl-7-methyl-1,4-diazepane
CID 82936957
5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine
CID 64862336
5,5-diethyl-1-[(1-ethylpiperidin-4-yl)methyl]-2-methylpiperazine
CID 64947875
1-cyclobutyl-5,5-diethyl-2-propan-2-ylpiperazine
CID 64948342
1-(3,5-dimethylcyclohexyl)-2,5,5-triethylpiperazine
CID 64940903
2,5,5-triethyl-1-(3-methylcyclohexyl)piperazine
CID 64935770
2,5,5-triethyl-1-(4-propylcyclohexyl)piperazine
CID 64948411

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine?
The IUPAC name of 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine (CID 64946348) is 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine.
What is the SMILES notation for 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine?
The canonical SMILES for 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine is CCC1(CC)CN(C2CCN(C3CC3)C2)C(C)CN1.
What is the InChIKey of 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine?
The InChIKey is OERMPARCEUNZFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-4-16(5-2)12-19(13(3)10-17-16)15-8-9-18(11-15)14-6-7-14/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine?
1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine has a molecular weight of 265.44 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylpyrrolidin-3-yl)-5,5-diethyl-2-methylpiperazine is sourced from PubChem (CID 64946348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).