2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine

C15H22Cl2N2 — CID 62332287

IUPAC2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
SMILESCC1CCN(C(CN)c2ccc(Cl)cc2Cl)C(C)C1
InChIInChI=1S/C15H22Cl2N2/c1-10-5-6-19(11(2)7-10)15(9-18)13-4-3-12(16)8-14(13)17/h3-4,8,10-11,15H,5-7,9,18H2,1-2H3
InChIKeyNITJJQPYLGSLAT-UHFFFAOYSA-N
MW301.26 g/mol
LogP4.11
Rot. Bonds3

About 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine

2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine (PubChem CID 62332287) has the molecular formula C15H22Cl2N2 and a molecular weight of 301.26 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
PubChem CID62332287
Molecular FormulaC15H22Cl2N2
Molecular Weight301.26 g/mol
Exact Mass300.12
IUPAC Name2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
SMILESCC1CCN(C(CN)c2ccc(Cl)cc2Cl)C(C)C1
InChIInChI=1S/C15H22Cl2N2/c1-10-5-6-19(11(2)7-10)15(9-18)13-4-3-12(16)8-14(13)17/h3-4,8,10-11,15H,5-7,9,18H2,1-2H3
InChIKeyNITJJQPYLGSLAT-UHFFFAOYSA-N
XLogP4.11
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.26
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chloro-4-fluorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
CID 81144769
2-(3,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
CID 62330318
2-(2,4-dimethylpiperidin-1-yl)-2-(2-methylphenyl)ethanamine
CID 62331932
1-[2-amino-1-(2,4-dichlorophenyl)ethyl]-N,N-dimethylpiperidin-4-amine
CID 43585830
1-[2-amino-1-(2,4-dichlorophenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63166284
2-(5-bromofuran-2-yl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
CID 62330319
2-(2,4-dichlorophenyl)-2-(3-methoxy-4-methylpiperidin-1-yl)ethanamine
CID 102964850
1-(4-chlorophenyl)-1-(2,4-dimethylpiperidin-1-yl)propan-2-amine
CID 62330116
1-(3-chlorophenyl)-1-(2,4-dimethylpiperidin-1-yl)butan-2-amine
CID 62330118
2-(5-chloro-2-fluorophenyl)-2-(4-methylazepan-1-yl)ethanamine
CID 114843187
2-(2,4-dichlorophenyl)-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107391282
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-(2-bromo-4-chlorophenyl)ethanamine
CID 82747639

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine (CID 62332287) is 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine is CC1CCN(C(CN)c2ccc(Cl)cc2Cl)C(C)C1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine?
The InChIKey is NITJJQPYLGSLAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2/c1-10-5-6-19(11(2)7-10)15(9-18)13-4-3-12(16)8-14(13)17/h3-4,8,10-11,15H,5-7,9,18H2,1-2H3.
What are the key properties of 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine?
2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine has a molecular weight of 301.26 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 62332287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).