3-amino-4,4-diphenylpentan-2-ol

C17H21NO — CID 18533371

IUPAC3-amino-4,4-diphenylpentan-2-ol
SMILESCC(O)C(N)C(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-13(19)16(18)17(2,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16,19H,18H2,1-2H3
InChIKeyWYVDUHPBHPTGSW-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.70
Rot. Bonds4

About 3-amino-4,4-diphenylpentan-2-ol

3-amino-4,4-diphenylpentan-2-ol (PubChem CID 18533371) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 3-amino-4,4-diphenylpentan-2-ol.

Molecular Properties

Compound Name3-amino-4,4-diphenylpentan-2-ol
PubChem CID18533371
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name3-amino-4,4-diphenylpentan-2-ol
SMILESCC(O)C(N)C(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-13(19)16(18)17(2,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16,19H,18H2,1-2H3
InChIKeyWYVDUHPBHPTGSW-UHFFFAOYSA-N
XLogP2.70
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1,1,1-triphenylbutan-2-amine
CID 67050578
3-methyl-3-phenylbutan-2-amine;hydrochloride
CID 24841347
(2S)-2-phenylbutane-2,3-diamine
CID 175403934
3-amino-2-methyl-2-phenylbutanoic acid
CID 67114284
2-(1,1-diphenylethyl)propanediamide
CID 175584560
3-amino-1,1-difluoro-1-phenylbutan-2-ol
CID 84669970
2,4-dimethyl-2-phenyl(313C)pentan-3-ol
CID 12036606
hydrogen peroxide;2,3,3-trimethylbutan-2-ylbenzene
CID 23026515
(2S)-1,1-diphenylpropane-1,2-diamine
CID 11172185
1-chloro-1,1-diphenylpropan-2-ol
CID 174806376
1,1-difluoro-1-phenylpropan-2-ol
CID 23235127
(2R)-4-methyl-4-phenylpentan-2-ol
CID 69029171

Frequently Asked Questions

What is the IUPAC name of 3-amino-4,4-diphenylpentan-2-ol?
The IUPAC name of 3-amino-4,4-diphenylpentan-2-ol (CID 18533371) is 3-amino-4,4-diphenylpentan-2-ol.
What is the SMILES notation for 3-amino-4,4-diphenylpentan-2-ol?
The canonical SMILES for 3-amino-4,4-diphenylpentan-2-ol is CC(O)C(N)C(C)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-amino-4,4-diphenylpentan-2-ol?
The InChIKey is WYVDUHPBHPTGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-13(19)16(18)17(2,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16,19H,18H2,1-2H3.
What are the key properties of 3-amino-4,4-diphenylpentan-2-ol?
3-amino-4,4-diphenylpentan-2-ol has a molecular weight of 255.36 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4,4-diphenylpentan-2-ol is sourced from PubChem (CID 18533371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).