2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol

C15H24N2O2 — CID 116987599

IUPAC2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol
SMILESCOc1cc(C(C)(C)CN2CCNCC2)ccc1O
InChIInChI=1S/C15H24N2O2/c1-15(2,11-17-8-6-16-7-9-17)12-4-5-13(18)14(10-12)19-3/h4-5,10,16,18H,6-9,11H2,1-3H3
InChIKeyPYGKHSNQPJNCHW-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.58
Rot. Bonds4

About 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol

2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol (PubChem CID 116987599) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol.

Molecular Properties

Compound Name2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol
PubChem CID116987599
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol
SMILESCOc1cc(C(C)(C)CN2CCNCC2)ccc1O
InChIInChI=1S/C15H24N2O2/c1-15(2,11-17-8-6-16-7-9-17)12-4-5-13(18)14(10-12)19-3/h4-5,10,16,18H,6-9,11H2,1-3H3
InChIKeyPYGKHSNQPJNCHW-UHFFFAOYSA-N
XLogP1.58
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide
CID 60992391
2-methoxy-4-(2-methyl-2-piperazin-1-ylpropyl)phenol
CID 116987601
4-(2-methylbutan-2-yl)-2-(2-piperazin-1-ylethyl)phenol
CID 117443167
2-methoxy-4-piperazin-1-ylphenol
CID 24820540
2-methoxy-4-[2,3,3-tris(4-hydroxy-3-methoxyphenyl)butan-2-yl]phenol
CID 141133714
2-(4-hydroxy-3-methoxyphenyl)-4-methylpentane-2,4-diol
CID 58389383
2-(2-methoxyphenyl)-1-piperazin-1-ylpropan-2-ol
CID 82297558
4-(2-fluoropropan-2-yl)-2-methoxyphenol
CID 84659603
4-[3-(4-hydroxy-3-methoxyphenyl)pentan-3-yl]-2-methoxyphenol
CID 118523796
2-methoxy-4-[(1R)-4,4,4-trifluoro-1-piperazin-1-ylbutyl]phenol;dihydrochloride
CID 171303539
4-[(1S)-3-fluoro-1-piperazin-1-ylpropyl]-2-methoxyphenol;hydrochloride
CID 171163905
1-[[5-(1,1-difluoroethyl)-2-methoxyphenyl]methyl]piperazine
CID 117429097

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol?
The IUPAC name of 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol (CID 116987599) is 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol.
What is the SMILES notation for 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol?
The canonical SMILES for 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol is COc1cc(C(C)(C)CN2CCNCC2)ccc1O.
What is the InChIKey of 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol?
The InChIKey is PYGKHSNQPJNCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2,11-17-8-6-16-7-9-17)12-4-5-13(18)14(10-12)19-3/h4-5,10,16,18H,6-9,11H2,1-3H3.
What are the key properties of 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol?
2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol has a molecular weight of 264.37 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol is sourced from PubChem (CID 116987599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).