[3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol

C11H18N2O — CID 143612778

IUPAC[3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol
SMILESCNCCN(C)c1cccc(CO)c1
InChIInChI=1S/C11H18N2O/c1-12-6-7-13(2)11-5-3-4-10(8-11)9-14/h3-5,8,12,14H,6-7,9H2,1-2H3
InChIKeyGSLIBDIQDDVIGK-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.83
Rot. Bonds5

About [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol

[3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol (PubChem CID 143612778) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol.

Molecular Properties

Compound Name[3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol
PubChem CID143612778
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol
SMILESCNCCN(C)c1cccc(CO)c1
InChIInChI=1S/C11H18N2O/c1-12-6-7-13(2)11-5-3-4-10(8-11)9-14/h3-5,8,12,14H,6-7,9H2,1-2H3
InChIKeyGSLIBDIQDDVIGK-UHFFFAOYSA-N
XLogP0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol?
The IUPAC name of [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol (CID 143612778) is [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol.
What is the SMILES notation for [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol?
The canonical SMILES for [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol is CNCCN(C)c1cccc(CO)c1.
What is the InChIKey of [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol?
The InChIKey is GSLIBDIQDDVIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-12-6-7-13(2)11-5-3-4-10(8-11)9-14/h3-5,8,12,14H,6-7,9H2,1-2H3.
What are the key properties of [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol?
[3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol has a molecular weight of 194.28 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[methyl-[2-(methylamino)ethyl]amino]phenyl]methanol is sourced from PubChem (CID 143612778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).