6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine

C22H27Cl2N — CID 152693245

IUPAC6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine
SMILESCC(CC(C)CN(C)C)=C(Cc1ccccc1Cl)c1ccc(Cl)cc1
InChIInChI=1S/C22H27Cl2N/c1-16(15-25(3)4)13-17(2)21(18-9-11-20(23)12-10-18)14-19-7-5-6-8-22(19)24/h5-12,16H,13-15H2,1-4H3
InChIKeyZPZXSNRXOSGBHW-UHFFFAOYSA-N
MW376.37 g/mol
LogP6.60
Rot. Bonds7

About 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine

6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine (PubChem CID 152693245) has the molecular formula C22H27Cl2N and a molecular weight of 376.37 g/mol. Its IUPAC name is 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine.

Molecular Properties

Compound Name6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine
PubChem CID152693245
Molecular FormulaC22H27Cl2N
Molecular Weight376.37 g/mol
Exact Mass375.15
IUPAC Name6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine
SMILESCC(CC(C)CN(C)C)=C(Cc1ccccc1Cl)c1ccc(Cl)cc1
InChIInChI=1S/C22H27Cl2N/c1-16(15-25(3)4)13-17(2)21(18-9-11-20(23)12-10-18)14-19-7-5-6-8-22(19)24/h5-12,16H,13-15H2,1-4H3
InChIKeyZPZXSNRXOSGBHW-UHFFFAOYSA-N
XLogP6.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.37
LogP ≤ 56.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-(3-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylpent-4-en-1-amine
CID 158245364
3-[(2-chlorophenyl)methyl]-4-(dimethylamino)butan-2-one
CID 67666684
(2R)-1-[(2-chlorophenyl)methyl-[(2R)-2-hydroxypropyl]amino]propan-2-ol
CID 756925
(2S)-1-[(2-chlorophenyl)methyl-[(2S)-2-hydroxypropyl]amino]propan-2-ol
CID 756928
2-(4-chlorophenyl)-1-(dimethylamino)-4-methylpentan-3-one
CID 58458140
2-(2-chlorophenyl)-N-[1-(2,4-dichlorophenyl)ethyl]-N-methylacetamide
CID 13268038
4-(2-chlorophenyl)-3-(4-chlorophenyl)butan-2-amine
CID 19073641
N-(4-chlorophenyl)-N',N',2-trimethylpropane-1,3-diamine
CID 547568
3-(2-chlorophenyl)-1-(4-chlorophenyl)propan-1-one
CID 86152302
4-chloro-N-(2-chloropropyl)-N-methylbenzamide
CID 63393567
3-amino-N-[(2-chlorophenyl)methyl]-N-(2-methylpropyl)propanamide
CID 39367425
4-chloro-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936052

Frequently Asked Questions

What is the IUPAC name of 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine?
The IUPAC name of 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine (CID 152693245) is 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine.
What is the SMILES notation for 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine?
The canonical SMILES for 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine is CC(CC(C)CN(C)C)=C(Cc1ccccc1Cl)c1ccc(Cl)cc1.
What is the InChIKey of 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine?
The InChIKey is ZPZXSNRXOSGBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27Cl2N/c1-16(15-25(3)4)13-17(2)21(18-9-11-20(23)12-10-18)14-19-7-5-6-8-22(19)24/h5-12,16H,13-15H2,1-4H3.
What are the key properties of 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine?
6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine has a molecular weight of 376.37 g/mol, XLogP of 6.60, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chlorophenyl)-5-(4-chlorophenyl)-N,N,2,4-tetramethylhex-4-en-1-amine is sourced from PubChem (CID 152693245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).