1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol

C15H25N3O — CID 62265781

IUPAC1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol
SMILESCN(C)C1CCN(CC(O)c2ccccc2N)CC1
InChIInChI=1S/C15H25N3O/c1-17(2)12-7-9-18(10-8-12)11-15(19)13-5-3-4-6-14(13)16/h3-6,12,15,19H,7-11,16H2,1-2H3
InChIKeyIYDZCQSZVGMPJM-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.33
Rot. Bonds4

About 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol

1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol (PubChem CID 62265781) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol
PubChem CID62265781
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol
SMILESCN(C)C1CCN(CC(O)c2ccccc2N)CC1
InChIInChI=1S/C15H25N3O/c1-17(2)12-7-9-18(10-8-12)11-15(19)13-5-3-4-6-14(13)16/h3-6,12,15,19H,7-11,16H2,1-2H3
InChIKeyIYDZCQSZVGMPJM-UHFFFAOYSA-N
XLogP1.33
TPSA52.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-[2-(2-aminophenyl)-2-hydroxyethyl]piperidin-4-ol
CID 62265241
1-(2-aminophenyl)-2-(4-ethoxypiperidin-1-yl)ethanol
CID 62264585
1-[2-(2-aminophenyl)-2-hydroxyethyl]-4-methylpiperidin-3-ol
CID 102956090
2-[3-(dimethylamino)pyrrolidin-1-yl]-1-(2-methylphenyl)ethanol
CID 55159139
1-[4-[2-(2-aminophenyl)-2-hydroxyethyl]-1,4-diazepan-1-yl]ethanone
CID 62266489
1-(3-bromophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol
CID 110898476
1-(2-aminophenyl)-2-(2-methyl-1,4-oxazepan-4-yl)ethanol
CID 62986854
1-(2-aminophenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanol
CID 62265085
1-(3-amino-2-phenylpropyl)-N,N-dimethylpiperidin-4-amine
CID 43585763
1-(2-aminophenyl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanol
CID 62266500
(1S)-1-[2-[4-(dimethylamino)piperidin-1-yl]phenyl]propan-1-ol
CID 103959777
7-[2-(2-aminophenyl)-2-hydroxyethyl]-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 79092169

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol?
The IUPAC name of 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol (CID 62265781) is 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol.
What is the SMILES notation for 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol?
The canonical SMILES for 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol is CN(C)C1CCN(CC(O)c2ccccc2N)CC1.
What is the InChIKey of 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol?
The InChIKey is IYDZCQSZVGMPJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-17(2)12-7-9-18(10-8-12)11-15(19)13-5-3-4-6-14(13)16/h3-6,12,15,19H,7-11,16H2,1-2H3.
What are the key properties of 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol?
1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol has a molecular weight of 263.38 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)-2-[4-(dimethylamino)piperidin-1-yl]ethanol is sourced from PubChem (CID 62265781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).