(4-methylpiperazin-2-yl)methanol

C6H14N2O — CID 12793177

IUPAC(4-methylpiperazin-2-yl)methanol
SMILESCN1CCNC(CO)C1
InChIInChI=1S/C6H14N2O/c1-8-3-2-7-6(4-8)5-9/h6-7,9H,2-5H2,1H3
InChIKeyJVIKJOXETSHPGJ-UHFFFAOYSA-N
MW130.19 g/mol
LogP-1.12
Rot. Bonds1

About (4-methylpiperazin-2-yl)methanol

(4-methylpiperazin-2-yl)methanol (PubChem CID 12793177) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is (4-methylpiperazin-2-yl)methanol.

Molecular Properties

Compound Name(4-methylpiperazin-2-yl)methanol
PubChem CID12793177
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name(4-methylpiperazin-2-yl)methanol
SMILESCN1CCNC(CO)C1
InChIInChI=1S/C6H14N2O/c1-8-3-2-7-6(4-8)5-9/h6-7,9H,2-5H2,1H3
InChIKeyJVIKJOXETSHPGJ-UHFFFAOYSA-N
XLogP-1.12
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-1.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-methylpiperazin-2-yl)methanol?
The IUPAC name of (4-methylpiperazin-2-yl)methanol (CID 12793177) is (4-methylpiperazin-2-yl)methanol.
What is the SMILES notation for (4-methylpiperazin-2-yl)methanol?
The canonical SMILES for (4-methylpiperazin-2-yl)methanol is CN1CCNC(CO)C1.
What is the InChIKey of (4-methylpiperazin-2-yl)methanol?
The InChIKey is JVIKJOXETSHPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-8-3-2-7-6(4-8)5-9/h6-7,9H,2-5H2,1H3.
What are the key properties of (4-methylpiperazin-2-yl)methanol?
(4-methylpiperazin-2-yl)methanol has a molecular weight of 130.19 g/mol, XLogP of -1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperazin-2-yl)methanol is sourced from PubChem (CID 12793177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).