2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol

C19H25NO — CID 62773138

IUPAC2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol
SMILESCCCNCC(C)(O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-14-20-15-19(2,21)18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,18,20-21H,3,14-15H2,1-2H3
InChIKeyWJNNMRXJDDWVCC-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.57
Rot. Bonds7

About 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol

2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol (PubChem CID 62773138) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol
PubChem CID62773138
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol
SMILESCCCNCC(C)(O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-14-20-15-19(2,21)18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,18,20-21H,3,14-15H2,1-2H3
InChIKeyWJNNMRXJDDWVCC-UHFFFAOYSA-N
XLogP3.57
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-3-(methylamino)-1-phenyl-1-(4-phenylsulfanylphenyl)propan-2-ol
CID 20573564
1-(benzhydrylamino)-2-methylpentan-2-ol
CID 103948284
2,2-dimethyl-3,3-diphenylpropan-1-ol
CID 15315706
2-methyl-1-(1-phenylbutylamino)butan-2-ol
CID 65107747
2-ethyl-2-phenyl-N-propylbutan-1-amine
CID 62596576
2,3-dimethyl-1,1-diphenylbutane-2,3-diol
CID 141069653
2-naphthalen-2-yl-1-(propylamino)propan-2-ol
CID 62772418
2-methyl-2-phenoxy-N-propylbutan-1-amine
CID 62353829
2,2-dimethyl-3-(2-methylphenyl)-N-propylpropan-1-amine
CID 62723929
2-methyl-1-[(2,2,2-trifluoro-1-phenylethyl)amino]pentan-2-ol
CID 106292736
2,2-dimethyl-5-phenyl-N-propylpentan-1-amine
CID 55107021
1-(benzhydrylamino)-2-methyl-3-methylsulfanylpropan-2-ol
CID 103948401

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol?
The IUPAC name of 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol (CID 62773138) is 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol?
The canonical SMILES for 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol is CCCNCC(C)(O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol?
The InChIKey is WJNNMRXJDDWVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-14-20-15-19(2,21)18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,18,20-21H,3,14-15H2,1-2H3.
What are the key properties of 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol?
2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol has a molecular weight of 283.42 g/mol, XLogP of 3.57, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,1-diphenyl-3-(propylamino)propan-2-ol is sourced from PubChem (CID 62773138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).