[4-(2-methylpropyl)piperazin-1-yl]methanol

C9H20N2O — CID 58575664

IUPAC[4-(2-methylpropyl)piperazin-1-yl]methanol
SMILESCC(C)CN1CCN(CO)CC1
InChIInChI=1S/C9H20N2O/c1-9(2)7-10-3-5-11(8-12)6-4-10/h9,12H,3-8H2,1-2H3
InChIKeyUHLYEMPYXOLZRT-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.21
Rot. Bonds3

About [4-(2-methylpropyl)piperazin-1-yl]methanol

[4-(2-methylpropyl)piperazin-1-yl]methanol (PubChem CID 58575664) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is [4-(2-methylpropyl)piperazin-1-yl]methanol.

Molecular Properties

Compound Name[4-(2-methylpropyl)piperazin-1-yl]methanol
PubChem CID58575664
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name[4-(2-methylpropyl)piperazin-1-yl]methanol
SMILESCC(C)CN1CCN(CO)CC1
InChIInChI=1S/C9H20N2O/c1-9(2)7-10-3-5-11(8-12)6-4-10/h9,12H,3-8H2,1-2H3
InChIKeyUHLYEMPYXOLZRT-UHFFFAOYSA-N
XLogP0.21
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-(2-methylpropyl)piperazine
CID 20562082
2-amino-2-methyl-3-[4-(2-methylpropyl)piperazin-1-yl]propan-1-ol
CID 64788004
4-[4-(2-methylpropyl)piperazin-1-yl]butan-1-ol
CID 62777800
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
azane;1-(2-methylpropyl)pyrrolidine
CID 122583370
2-[4-(2-methylpropyl)-1,4-diazepan-1-yl]propane-1,3-diol
CID 50962485
2-[4-(2-methylpropyl)piperazin-1-yl]acetic acid;dihydrochloride
CID 53420787
1,1,1-trifluoro-3-[4-(2-methylpropyl)piperazin-1-yl]propan-2-ol
CID 63900205
4-(2-methylpropyl)piperazine-1-carbonyl chloride
CID 79887256
2-methyl-3-[4-(2-methylpropyl)piperazin-1-yl]propanethioamide
CID 62777249
2-[4-(2-methylpropyl)piperazin-1-yl]-2-oxoacetic acid
CID 2051289
2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine
CID 4742453

Frequently Asked Questions

What is the IUPAC name of [4-(2-methylpropyl)piperazin-1-yl]methanol?
The IUPAC name of [4-(2-methylpropyl)piperazin-1-yl]methanol (CID 58575664) is [4-(2-methylpropyl)piperazin-1-yl]methanol.
What is the SMILES notation for [4-(2-methylpropyl)piperazin-1-yl]methanol?
The canonical SMILES for [4-(2-methylpropyl)piperazin-1-yl]methanol is CC(C)CN1CCN(CO)CC1.
What is the InChIKey of [4-(2-methylpropyl)piperazin-1-yl]methanol?
The InChIKey is UHLYEMPYXOLZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-9(2)7-10-3-5-11(8-12)6-4-10/h9,12H,3-8H2,1-2H3.
What are the key properties of [4-(2-methylpropyl)piperazin-1-yl]methanol?
[4-(2-methylpropyl)piperazin-1-yl]methanol has a molecular weight of 172.27 g/mol, XLogP of 0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylpropyl)piperazin-1-yl]methanol is sourced from PubChem (CID 58575664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).