3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol

C18H23NO — CID 107292892

IUPAC3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol
SMILESCC(C)NC(CO)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-14(2)19-17(13-20)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17-20H,13H2,1-2H3
InChIKeyFDPZVJXWHYZDHE-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.18
Rot. Bonds6

About 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol

3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol (PubChem CID 107292892) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol.

Molecular Properties

Compound Name3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol
PubChem CID107292892
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol
SMILESCC(C)NC(CO)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-14(2)19-17(13-20)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17-20H,13H2,1-2H3
InChIKeyFDPZVJXWHYZDHE-UHFFFAOYSA-N
XLogP3.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R)-3-(1-phenylethylamino)butane-1,2,4-triol
CID 70991072
(1S)-1-phenyl-N-propan-2-ylpropan-1-amine
CID 14387504
(2S)-2-[[(1R)-2-methoxy-1-phenylethyl]amino]-3-methylbutan-1-ol
CID 101092421
2-(3-methylbutan-2-ylamino)-1-phenylpropane-1,3-diol
CID 23274552
2-(benzhydrylamino)propan-1-ol
CID 43499566
2-[(1-hydroxy-3-methylbutan-2-yl)amino]-2-phenylacetic acid
CID 103256512
4,4,4-trifluoro-2-(1-phenylethylamino)-3-(trifluoromethyl)butan-1-ol
CID 23585140
(2S)-2-(1,1-diphenylpropan-2-ylamino)-3,3-dimethylbutan-1-ol
CID 56859290
(2S)-2-[(2-methyl-1-phenylpropyl)amino]-2-phenylethanol
CID 107862261
1-phenyl-N-propan-2-ylbutan-1-amine
CID 43177244
2-(cyclopentylamino)-3-phenylbutan-1-ol
CID 61309786
2-(1-cyclopentylethylamino)-2-phenylethanol
CID 63182560

Frequently Asked Questions

What is the IUPAC name of 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol?
The IUPAC name of 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol (CID 107292892) is 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol.
What is the SMILES notation for 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol?
The canonical SMILES for 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol is CC(C)NC(CO)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol?
The InChIKey is FDPZVJXWHYZDHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-14(2)19-17(13-20)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17-20H,13H2,1-2H3.
What are the key properties of 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol?
3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol has a molecular weight of 269.39 g/mol, XLogP of 3.18, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diphenyl-2-(propan-2-ylamino)propan-1-ol is sourced from PubChem (CID 107292892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).