2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane

C19H26ClN — CID 143339031

IUPAC2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane
SMILESCC.CCc1ccc(C(CNC)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H20ClN.C2H6/c1-3-13-4-6-14(7-5-13)17(12-19-2)15-8-10-16(18)11-9-15;1-2/h4-11,17,19H,3,12H2,1-2H3;1-2H3
InChIKeyYMGMLZODONDNSY-UHFFFAOYSA-N
MW303.88 g/mol
LogP5.28
Rot. Bonds5

About 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane

2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane (PubChem CID 143339031) has the molecular formula C19H26ClN and a molecular weight of 303.88 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane
PubChem CID143339031
Molecular FormulaC19H26ClN
Molecular Weight303.88 g/mol
Exact Mass303.18
IUPAC Name2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane
SMILESCC.CCc1ccc(C(CNC)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H20ClN.C2H6/c1-3-13-4-6-14(7-5-13)17(12-19-2)15-8-10-16(18)11-9-15;1-2/h4-11,17,19H,3,12H2,1-2H3;1-2H3
InChIKeyYMGMLZODONDNSY-UHFFFAOYSA-N
XLogP5.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.88
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-chloro-4-ethylbenzene;1-(4-chlorophenyl)ethanol
CID 22925659
1-chloro-4-[2-chloro-2-(4-ethylphenyl)ethyl]benzene
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2-(4-chlorophenyl)-N-methyl-3-phenylpropan-1-amine
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ethane;1-ethyl-4-propan-2-ylbenzene
CID 145053715
N-[(1S)-1-(4-chlorophenyl)ethyl]-1-(4-ethylphenyl)propan-1-amine
CID 81350091
N-[(4-chlorophenyl)methyl]-1-(4-ethylphenyl)methanamine
CID 29031068
2-N-[1-(4-chlorophenyl)ethyl]-1-N,2-N-dimethylpropane-1,2-diamine
CID 62984553
2-(4-ethylphenyl)-N-methyl-2-propan-2-yloxyethanamine
CID 53276085
2-(4-chloroanilino)-2-(4-ethylphenyl)acetonitrile
CID 54886237
2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 93236026
1-(4-ethylphenyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine
CID 116945849
1,4-diethylbenzene;ethane
CID 91207141

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane?
The IUPAC name of 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane (CID 143339031) is 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane.
What is the SMILES notation for 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane?
The canonical SMILES for 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane is CC.CCc1ccc(C(CNC)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane?
The InChIKey is YMGMLZODONDNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClN.C2H6/c1-3-13-4-6-14(7-5-13)17(12-19-2)15-8-10-16(18)11-9-15;1-2/h4-11,17,19H,3,12H2,1-2H3;1-2H3.
What are the key properties of 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane?
2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane has a molecular weight of 303.88 g/mol, XLogP of 5.28, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-(4-ethylphenyl)-N-methylethanamine;ethane is sourced from PubChem (CID 143339031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).