1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol

C12H24N2O — CID 63908037

IUPAC1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol
SMILESCC(C)N1CCN(CC(O)C2CC2)CC1
InChIInChI=1S/C12H24N2O/c1-10(2)14-7-5-13(6-8-14)9-12(15)11-3-4-11/h10-12,15H,3-9H2,1-2H3
InChIKeyAZIGTLMDDNHNNY-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.78
Rot. Bonds4

About 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol

1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol (PubChem CID 63908037) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol
PubChem CID63908037
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol
SMILESCC(C)N1CCN(CC(O)C2CC2)CC1
InChIInChI=1S/C12H24N2O/c1-10(2)14-7-5-13(6-8-14)9-12(15)11-3-4-11/h10-12,15H,3-9H2,1-2H3
InChIKeyAZIGTLMDDNHNNY-UHFFFAOYSA-N
XLogP0.78
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
The IUPAC name of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol (CID 63908037) is 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol is CC(C)N1CCN(CC(O)C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
The InChIKey is AZIGTLMDDNHNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)14-7-5-13(6-8-14)9-12(15)11-3-4-11/h10-12,15H,3-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol has a molecular weight of 212.34 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol is sourced from PubChem (CID 63908037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).