2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol

C16H19NO — CID 19358994

IUPAC2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol
SMILESCc1ccc(C(O)(c2ccccc2)C(C)N)cc1
InChIInChI=1S/C16H19NO/c1-12-8-10-15(11-9-12)16(18,13(2)17)14-6-4-3-5-7-14/h3-11,13,18H,17H2,1-2H3
InChIKeyXHLXJQIUDHIFBB-UHFFFAOYSA-N
MW241.33 g/mol
LogP2.58
Rot. Bonds3

About 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol

2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol (PubChem CID 19358994) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol
PubChem CID19358994
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol
SMILESCc1ccc(C(O)(c2ccccc2)C(C)N)cc1
InChIInChI=1S/C16H19NO/c1-12-8-10-15(11-9-12)16(18,13(2)17)14-6-4-3-5-7-14/h3-11,13,18H,17H2,1-2H3
InChIKeyXHLXJQIUDHIFBB-UHFFFAOYSA-N
XLogP2.58
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-(4-chlorophenyl)-1-phenylpropan-1-ol;hydrochloride
CID 24834780
(2S)-2-amino-3-methyl-1,1-bis(4-methylphenyl)butan-1-ol
CID 18640444
(2S)-2-amino-1,1-bis(4-methylphenyl)-3-phenylpropan-1-ol
CID 101072833
(2R)-2-amino-1,1-bis(4-methylphenyl)-3-phenylpropan-1-ol
CID 22084869
2-amino-3,3-dimethyl-1,1-bis(4-methylphenyl)butan-1-ol
CID 18373849
3-hydroxy-2-methyl-3,3-bis(4-methylphenyl)propanenitrile
CID 163818996
1-(4-aminophenyl)-2-methyl-1-phenylpropan-1-ol
CID 22890028
1-methyl-4-[(4-methylphenyl)-diphenylmethyl]benzene
CID 22957062
N-[2-[3-(2-amino-1-hydroxy-1-phenylpropyl)phenyl]-2-[(4-methylphenyl)sulfonylamino]-1,2-diphenylethyl]-4-methylbenzenesulfonamide
CID 69320190
(2S)-1,1-diphenylpropane-1,2-diamine
CID 11172185
3-methyl-1,1,1-triphenylbutan-2-amine
CID 67050578
(2R)-2-amino-1,1-diphenyl-3-(propan-2-ylamino)propan-1-ol
CID 134905502

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol?
The IUPAC name of 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol (CID 19358994) is 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol.
What is the SMILES notation for 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol?
The canonical SMILES for 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol is Cc1ccc(C(O)(c2ccccc2)C(C)N)cc1.
What is the InChIKey of 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol?
The InChIKey is XHLXJQIUDHIFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-12-8-10-15(11-9-12)16(18,13(2)17)14-6-4-3-5-7-14/h3-11,13,18H,17H2,1-2H3.
What are the key properties of 2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol?
2-amino-1-(4-methylphenyl)-1-phenylpropan-1-ol has a molecular weight of 241.33 g/mol, XLogP of 2.58, 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-methylphenyl)-1-phenylpropan-1-ol is sourced from PubChem (CID 19358994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).