1-(3,5-dichloroanilino)-2-phenylpropan-2-ol

C15H15Cl2NO — CID 62373813

IUPAC1-(3,5-dichloroanilino)-2-phenylpropan-2-ol
SMILESCC(O)(CNc1cc(Cl)cc(Cl)c1)c1ccccc1
InChIInChI=1S/C15H15Cl2NO/c1-15(19,11-5-3-2-4-6-11)10-18-14-8-12(16)7-13(17)9-14/h2-9,18-19H,10H2,1H3
InChIKeyTZDCTMQPEOLPQE-UHFFFAOYSA-N
MW296.20 g/mol
LogP4.31
Rot. Bonds4

About 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol

1-(3,5-dichloroanilino)-2-phenylpropan-2-ol (PubChem CID 62373813) has the molecular formula C15H15Cl2NO and a molecular weight of 296.20 g/mol. Its IUPAC name is 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol.

Molecular Properties

Compound Name1-(3,5-dichloroanilino)-2-phenylpropan-2-ol
PubChem CID62373813
Molecular FormulaC15H15Cl2NO
Molecular Weight296.20 g/mol
Exact Mass295.05
IUPAC Name1-(3,5-dichloroanilino)-2-phenylpropan-2-ol
SMILESCC(O)(CNc1cc(Cl)cc(Cl)c1)c1ccccc1
InChIInChI=1S/C15H15Cl2NO/c1-15(19,11-5-3-2-4-6-11)10-18-14-8-12(16)7-13(17)9-14/h2-9,18-19H,10H2,1H3
InChIKeyTZDCTMQPEOLPQE-UHFFFAOYSA-N
XLogP4.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-tert-butylanilino)-2-phenylpropan-2-ol
CID 62373659
N-[4-[(2-hydroxy-2-phenylpropyl)amino]phenyl]acetamide
CID 62373656
3,5-dichloro-N-(2-phenylprop-2-enyl)aniline
CID 113288075
1-(methylamino)-2-phenylpropan-2-ol;palladium;tetrahydrochloride
CID 173355754
1-(2-fluoro-5-methylanilino)-2-phenylpropan-2-ol
CID 62375666
1-[1-(2,4-dichlorophenyl)ethylamino]-2-phenylpropan-2-ol
CID 62373504
2,4-dichloro-N-(2-hydroxy-2-phenylpropyl)benzamide
CID 111335243
2-(4-chlorophenyl)-N-(2-hydroxy-2-phenylpropyl)acetamide
CID 110663977
4-(3,5-dichloroanilino)-3-hydroxy-3-methylbutanamide
CID 67066712
3-chloro-N-(2,2-difluoro-2-phenylethyl)aniline
CID 116788755
1-(3,4-difluorophenyl)-3-(2-hydroxy-2-phenylpropyl)urea
CID 111335572
N'-(3-chloro-4-fluorophenyl)-N-[(2S)-2-hydroxy-2-phenylpropyl]oxamide
CID 95368093

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol?
The IUPAC name of 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol (CID 62373813) is 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol.
What is the SMILES notation for 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol?
The canonical SMILES for 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol is CC(O)(CNc1cc(Cl)cc(Cl)c1)c1ccccc1.
What is the InChIKey of 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol?
The InChIKey is TZDCTMQPEOLPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO/c1-15(19,11-5-3-2-4-6-11)10-18-14-8-12(16)7-13(17)9-14/h2-9,18-19H,10H2,1H3.
What are the key properties of 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol?
1-(3,5-dichloroanilino)-2-phenylpropan-2-ol has a molecular weight of 296.20 g/mol, XLogP of 4.31, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichloroanilino)-2-phenylpropan-2-ol is sourced from PubChem (CID 62373813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).