2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride

C15H17Cl2NO — CID 24834780

IUPAC2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride
SMILESCC(N)C(O)(c1ccccc1)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C15H16ClNO.ClH/c1-11(17)15(18,12-5-3-2-4-6-12)13-7-9-14(16)10-8-13;/h2-11,18H,17H2,1H3;1H
InChIKeyNZFNTQLFETYXTC-UHFFFAOYSA-N
MW298.21 g/mol
LogP3.34
Rot. Bonds3

About 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride

2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride (PubChem CID 24834780) has the molecular formula C15H17Cl2NO and a molecular weight of 298.21 g/mol. Its IUPAC name is 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride
PubChem CID24834780
Molecular FormulaC15H17Cl2NO
Molecular Weight298.21 g/mol
Exact Mass297.07
IUPAC Name2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride
SMILESCC(N)C(O)(c1ccccc1)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C15H16ClNO.ClH/c1-11(17)15(18,12-5-3-2-4-6-12)13-7-9-14(16)10-8-13;/h2-11,18H,17H2,1H3;1H
InChIKeyNZFNTQLFETYXTC-UHFFFAOYSA-N
XLogP3.34
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.21
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol
CID 19358994
bis(4-chlorophenyl)-phenylmethanamine
CID 134589032
3-methyl-3-phenylbutan-2-amine;hydrochloride
CID 24841347
1-(4-aminophenyl)-2-methyl-1-phenylpropan-1-ol
CID 22890028
1-chloro-4-tritylbenzene
CID 14737307
1-(4-chlorophenyl)-2-methyl-2-phenylpropan-1-amine
CID 43184848
1-chloro-4-[dichloro(phenyl)methyl]benzene
CID 11000180
3-methyl-1,1,1-triphenylbutan-2-amine
CID 67050578
(2S)-1,1-diphenylpropane-1,2-diamine
CID 11172185
1-amino-1-(4-chlorophenyl)ethanol
CID 23370677
(2R)-2-amino-1,1-diphenyl-3-(propan-2-ylamino)propan-1-ol
CID 134905502
1-(3,4-dichlorophenyl)-1,1-diphenylpropan-2-amine
CID 54046222

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride?
The IUPAC name of 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride (CID 24834780) is 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride.
What is the SMILES notation for 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride?
The canonical SMILES for 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride is CC(N)C(O)(c1ccccc1)c1ccc(Cl)cc1.Cl.
What is the InChIKey of 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride?
The InChIKey is NZFNTQLFETYXTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO.ClH/c1-11(17)15(18,12-5-3-2-4-6-12)13-7-9-14(16)10-8-13;/h2-11,18H,17H2,1H3;1H.
What are the key properties of 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride?
2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride has a molecular weight of 298.21 g/mol, XLogP of 3.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride is sourced from PubChem (CID 24834780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).