(2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine

C11H15Cl2N — CID 131150424

IUPAC(2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine
SMILESCC(C)[C@@](C)(N)c1ccc(Cl)cc1Cl
InChIInChI=1S/C11H15Cl2N/c1-7(2)11(3,14)9-5-4-8(12)6-10(9)13/h4-7H,14H2,1-3H3/t11-/m1/s1
InChIKeyWUKSHFPOMVCKRQ-LLVKDONJSA-N
MW232.15 g/mol
LogP3.82
Rot. Bonds2

About (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine

(2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine (PubChem CID 131150424) has the molecular formula C11H15Cl2N and a molecular weight of 232.15 g/mol. Its IUPAC name is (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine.

Molecular Properties

Compound Name(2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine
PubChem CID131150424
Molecular FormulaC11H15Cl2N
Molecular Weight232.15 g/mol
Exact Mass231.06
IUPAC Name(2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine
SMILESCC(C)[C@@](C)(N)c1ccc(Cl)cc1Cl
InChIInChI=1S/C11H15Cl2N/c1-7(2)11(3,14)9-5-4-8(12)6-10(9)13/h4-7H,14H2,1-3H3/t11-/m1/s1
InChIKeyWUKSHFPOMVCKRQ-LLVKDONJSA-N
XLogP3.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.15
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,4-dichloro-5-fluorophenyl)-3-methylbutan-2-amine
CID 60929261
2-(2,4-dichlorophenyl)propan-2-ol
CID 67803482
3-(2,4-dichlorophenyl)pentan-3-amine
CID 60987757
2-(2,4-dichlorophenyl)-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 63517804
2-(2,4-dichlorophenyl)-2-(propan-2-ylamino)propanamide
CID 54918479
(2R)-2-(2,4-dichlorophenyl)-2-fluoropropan-1-amine
CID 124567259
2,4-dichloro-1-(2-methylbut-3-en-2-yl)benzene
CID 131994334
2-(2,4-dichlorophenyl)-2-methylpropane-1-sulfonyl chloride
CID 82308452
2-(4-chloro-2-methylphenyl)propan-2-amine
CID 82280968
2-chloro-2-(2,4-dichlorophenyl)propanal
CID 20571053
(2S)-2-(2,5-dichlorophenyl)butan-2-amine
CID 130054976
(2S)-2-(2,4-dichlorophenyl)-2-fluoropropanenitrile
CID 124567272

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine?
The IUPAC name of (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine (CID 131150424) is (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine.
What is the SMILES notation for (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine?
The canonical SMILES for (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine is CC(C)[C@@](C)(N)c1ccc(Cl)cc1Cl.
What is the InChIKey of (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine?
The InChIKey is WUKSHFPOMVCKRQ-LLVKDONJSA-N. The full InChI is InChI=1S/C11H15Cl2N/c1-7(2)11(3,14)9-5-4-8(12)6-10(9)13/h4-7H,14H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine?
(2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine has a molecular weight of 232.15 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,4-dichlorophenyl)-3-methylbutan-2-amine is sourced from PubChem (CID 131150424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).