3-amino-2-(2,3-dichlorophenyl)butan-2-ol

C10H13Cl2NO — CID 130574322

IUPAC3-amino-2-(2,3-dichlorophenyl)butan-2-ol
SMILESCC(N)C(C)(O)c1cccc(Cl)c1Cl
InChIInChI=1S/C10H13Cl2NO/c1-6(13)10(2,14)7-4-3-5-8(11)9(7)12/h3-6,14H,13H2,1-2H3
InChIKeyUXIHYXBUCXXGRU-UHFFFAOYSA-N
MW234.13 g/mol
LogP2.55
Rot. Bonds2

About 3-amino-2-(2,3-dichlorophenyl)butan-2-ol

3-amino-2-(2,3-dichlorophenyl)butan-2-ol (PubChem CID 130574322) has the molecular formula C10H13Cl2NO and a molecular weight of 234.13 g/mol. Its IUPAC name is 3-amino-2-(2,3-dichlorophenyl)butan-2-ol.

Molecular Properties

Compound Name3-amino-2-(2,3-dichlorophenyl)butan-2-ol
PubChem CID130574322
Molecular FormulaC10H13Cl2NO
Molecular Weight234.13 g/mol
Exact Mass233.04
IUPAC Name3-amino-2-(2,3-dichlorophenyl)butan-2-ol
SMILESCC(N)C(C)(O)c1cccc(Cl)c1Cl
InChIInChI=1S/C10H13Cl2NO/c1-6(13)10(2,14)7-4-3-5-8(11)9(7)12/h3-6,14H,13H2,1-2H3
InChIKeyUXIHYXBUCXXGRU-UHFFFAOYSA-N
XLogP2.55
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.13
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dichlorophenyl)-1,1-dimethoxypropan-2-ol
CID 66037184
3-amino-2-[2-(trifluoromethyl)phenyl]butan-2-ol
CID 105492277
2-(3-chloro-2-methylphenyl)-3-methylbutan-2-ol
CID 91657388
2-(2,3-dichlorophenyl)-2-methylpropan-1-amine;hydrochloride
CID 57455746
3-(2-chlorophenyl)-3-fluorobutan-2-amine
CID 105454003
1-(2,3-dichlorophenyl)-1-(4-fluorophenyl)ethanol
CID 55116262
(2-tert-butylphenyl)-(2,3-dichlorophenyl)methanamine
CID 115851470
2-(2,3-dichlorophenyl)-2-fluoropropan-1-amine
CID 112565101
(2R)-2-(2,3-dichlorophenyl)but-3-en-2-amine
CID 130739567
1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)ethanol
CID 63407186
2,2-bis(2,3-dichlorophenyl)propanediamide
CID 69106750
2-(2,3-dichlorophenyl)-2-methylpropanal
CID 131011791

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(2,3-dichlorophenyl)butan-2-ol?
The IUPAC name of 3-amino-2-(2,3-dichlorophenyl)butan-2-ol (CID 130574322) is 3-amino-2-(2,3-dichlorophenyl)butan-2-ol.
What is the SMILES notation for 3-amino-2-(2,3-dichlorophenyl)butan-2-ol?
The canonical SMILES for 3-amino-2-(2,3-dichlorophenyl)butan-2-ol is CC(N)C(C)(O)c1cccc(Cl)c1Cl.
What is the InChIKey of 3-amino-2-(2,3-dichlorophenyl)butan-2-ol?
The InChIKey is UXIHYXBUCXXGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2NO/c1-6(13)10(2,14)7-4-3-5-8(11)9(7)12/h3-6,14H,13H2,1-2H3.
What are the key properties of 3-amino-2-(2,3-dichlorophenyl)butan-2-ol?
3-amino-2-(2,3-dichlorophenyl)butan-2-ol has a molecular weight of 234.13 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(2,3-dichlorophenyl)butan-2-ol is sourced from PubChem (CID 130574322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).