1-cyclopropyl-2-piperazin-1-ylethanol

C9H18N2O — CID 5109435

IUPAC1-cyclopropyl-2-piperazin-1-ylethanol
SMILESOC(CN1CCNCC1)C1CC1
InChIInChI=1S/C9H18N2O/c12-9(8-1-2-8)7-11-5-3-10-4-6-11/h8-10,12H,1-7H2
InChIKeyBKXMLTKMQVGJFY-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.34
Rot. Bonds3

About 1-cyclopropyl-2-piperazin-1-ylethanol

1-cyclopropyl-2-piperazin-1-ylethanol (PubChem CID 5109435) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-cyclopropyl-2-piperazin-1-ylethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-piperazin-1-ylethanol
PubChem CID5109435
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-cyclopropyl-2-piperazin-1-ylethanol
SMILESOC(CN1CCNCC1)C1CC1
InChIInChI=1S/C9H18N2O/c12-9(8-1-2-8)7-11-5-3-10-4-6-11/h8-10,12H,1-7H2
InChIKeyBKXMLTKMQVGJFY-UHFFFAOYSA-N
XLogP-0.34
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-piperazin-1-ylethanol?
The IUPAC name of 1-cyclopropyl-2-piperazin-1-ylethanol (CID 5109435) is 1-cyclopropyl-2-piperazin-1-ylethanol.
What is the SMILES notation for 1-cyclopropyl-2-piperazin-1-ylethanol?
The canonical SMILES for 1-cyclopropyl-2-piperazin-1-ylethanol is OC(CN1CCNCC1)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-piperazin-1-ylethanol?
The InChIKey is BKXMLTKMQVGJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c12-9(8-1-2-8)7-11-5-3-10-4-6-11/h8-10,12H,1-7H2.
What are the key properties of 1-cyclopropyl-2-piperazin-1-ylethanol?
1-cyclopropyl-2-piperazin-1-ylethanol has a molecular weight of 170.26 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-piperazin-1-ylethanol is sourced from PubChem (CID 5109435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).