2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol

C15H26N2O2 — CID 63698745

IUPAC2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(O)CN(C)CCCN(C)C)cc1
InChIInChI=1S/C15H26N2O2/c1-16(2)10-5-11-17(3)12-15(18)13-6-8-14(19-4)9-7-13/h6-9,15,18H,5,10-12H2,1-4H3
InChIKeyCAVXADFESSULFZ-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.61
Rot. Bonds8

About 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol

2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol (PubChem CID 63698745) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol
PubChem CID63698745
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(O)CN(C)CCCN(C)C)cc1
InChIInChI=1S/C15H26N2O2/c1-16(2)10-5-11-17(3)12-15(18)13-6-8-14(19-4)9-7-13/h6-9,15,18H,5,10-12H2,1-4H3
InChIKeyCAVXADFESSULFZ-UHFFFAOYSA-N
XLogP1.61
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[butyl(methyl)amino]-1-(4-methoxyphenyl)ethanol
CID 54944684
2-[3-(dimethylamino)propyl-methylamino]-1-(4-propan-2-yloxyphenyl)ethanol
CID 63699784
2-[ethyl(methyl)amino]-1-(4-methoxyphenyl)ethanol
CID 60972520
1-(3,4-dimethoxyphenyl)-2-[2-(dimethylamino)ethyl-methylamino]ethanol
CID 63699776
2-[bis(2-methylpropyl)amino]-1-(4-methoxyphenyl)ethanol
CID 60969080
2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol
CID 63701341
2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol
CID 60980971
1-(4-chlorophenyl)-2-[3-methoxypropyl(methyl)amino]ethanol
CID 110908142
1-(4-methoxyphenyl)(213C)ethane-1,2-diol
CID 101170566
2-[3-(dimethylamino)propyl-methylamino]-1-naphthalen-1-ylethanol
CID 63700824
1-(4-methoxyphenyl)-4-methylpentan-1-ol
CID 61101415
1-(4-methoxyphenyl)pentan-1-ol
CID 10176510

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol?
The IUPAC name of 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol (CID 63698745) is 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol?
The canonical SMILES for 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol is COc1ccc(C(O)CN(C)CCCN(C)C)cc1.
What is the InChIKey of 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol?
The InChIKey is CAVXADFESSULFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-16(2)10-5-11-17(3)12-15(18)13-6-8-14(19-4)9-7-13/h6-9,15,18H,5,10-12H2,1-4H3.
What are the key properties of 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol?
2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol has a molecular weight of 266.38 g/mol, XLogP of 1.61, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 63698745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).