1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol

C19H25N3O — CID 21292120

IUPAC1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol
SMILESNCc1ccccc1C(O)CN1CCNCC1c1ccccc1
InChIInChI=1S/C19H25N3O/c20-12-16-8-4-5-9-17(16)19(23)14-22-11-10-21-13-18(22)15-6-2-1-3-7-15/h1-9,18-19,21,23H,10-14,20H2
InChIKeyZRPIPHNLSHEBGT-UHFFFAOYSA-N
MW311.43 g/mol
LogP1.83
Rot. Bonds5

About 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol

1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol (PubChem CID 21292120) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol
PubChem CID21292120
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol
SMILESNCc1ccccc1C(O)CN1CCNCC1c1ccccc1
InChIInChI=1S/C19H25N3O/c20-12-16-8-4-5-9-17(16)19(23)14-22-11-10-21-13-18(22)15-6-2-1-3-7-15/h1-9,18-19,21,23H,10-14,20H2
InChIKeyZRPIPHNLSHEBGT-UHFFFAOYSA-N
XLogP1.83
TPSA61.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)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

1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol
CID 21292084
4-[2-[2-(aminomethyl)phenyl]-2-hydroxyethyl]-3-phenylpiperazin-2-one
CID 70381027
1-(4-chlorophenyl)-2-(2-phenylpiperazin-1-yl)ethanol;dihydrochloride
CID 21292088
1-(2-phenylpiperazin-1-yl)heptan-2-ol
CID 70408469
1-[3-[ethyl(methyl)amino]phenyl]-2-(2-phenylpiperazin-1-yl)ethanol
CID 21292113
1-(3-fluoropropyl)-2-phenylpiperazine
CID 81114300
[(7S,11bS)-7-phenyl-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinolin-8-yl]methanamine;dihydrochloride
CID 70381041
trimethyl-[(2-phenylpiperazin-1-yl)methyl]silane
CID 10444724
1-(cyclobutylmethyl)-2-phenylpiperazine
CID 64936519
1-(cyclopentylmethyl)-2-phenylpiperazine
CID 64832948
1-benzyl-2-(4-chlorophenyl)piperazine
CID 22074529
2-[(2S)-2-methylpiperazin-1-yl]-1-phenylethanol
CID 82755402

Frequently Asked Questions

What is the IUPAC name of 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol?
The IUPAC name of 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol (CID 21292120) is 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol.
What is the SMILES notation for 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol?
The canonical SMILES for 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol is NCc1ccccc1C(O)CN1CCNCC1c1ccccc1.
What is the InChIKey of 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol?
The InChIKey is ZRPIPHNLSHEBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c20-12-16-8-4-5-9-17(16)19(23)14-22-11-10-21-13-18(22)15-6-2-1-3-7-15/h1-9,18-19,21,23H,10-14,20H2.
What are the key properties of 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol?
1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol has a molecular weight of 311.43 g/mol, XLogP of 1.83, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(aminomethyl)phenyl]-2-(2-phenylpiperazin-1-yl)ethanol is sourced from PubChem (CID 21292120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).