1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine

C13H19ClN2 — CID 117020121

IUPAC1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine
SMILESCC1(C)CC(N)CCN1c1ccccc1Cl
InChIInChI=1S/C13H19ClN2/c1-13(2)9-10(15)7-8-16(13)12-6-4-3-5-11(12)14/h3-6,10H,7-9,15H2,1-2H3
InChIKeyXZXUCNODXLIMIE-UHFFFAOYSA-N
MW238.76 g/mol
LogP3.05
Rot. Bonds1

About 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine

1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine (PubChem CID 117020121) has the molecular formula C13H19ClN2 and a molecular weight of 238.76 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine
PubChem CID117020121
Molecular FormulaC13H19ClN2
Molecular Weight238.76 g/mol
Exact Mass238.12
IUPAC Name1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine
SMILESCC1(C)CC(N)CCN1c1ccccc1Cl
InChIInChI=1S/C13H19ClN2/c1-13(2)9-10(15)7-8-16(13)12-6-4-3-5-11(12)14/h3-6,10H,7-9,15H2,1-2H3
InChIKeyXZXUCNODXLIMIE-UHFFFAOYSA-N
XLogP3.05
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.76
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-chlorophenyl)-5,5-dimethylpyrrolidin-3-amine
CID 117018127
2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine
CID 117020100
1-(2-chlorophenyl)-6,6-dimethylpiperidin-3-amine
CID 117021020
[1-(2-chlorophenyl)-5,5-dimethylpyrrolidin-3-yl]methanol
CID 117018867
2-[1-(2-chlorophenyl)-2,2-dimethylpyrrolidin-3-yl]ethanamine
CID 117017576
1-(2,3-dichlorophenyl)-2,2-dimethylpyrrolidin-3-amine
CID 117017057
2-[1-(2-chlorophenyl)-5,5-dimethylpyrrolidin-3-yl]acetonitrile
CID 117018622
[1-(2-chlorophenyl)-3,3-dimethylpiperidin-4-yl]methanamine
CID 117024878
1-(2-chlorophenyl)-N,2,2-trimethylpiperidin-3-amine
CID 117019307
1-(4-ethylphenyl)-2,2-dimethylpiperidin-4-amine
CID 117020110
4-amino-1-(2-chlorophenyl)piperidin-2-one
CID 83642987
1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine
CID 117018125

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine?
The IUPAC name of 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine (CID 117020121) is 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine is CC1(C)CC(N)CCN1c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine?
The InChIKey is XZXUCNODXLIMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2/c1-13(2)9-10(15)7-8-16(13)12-6-4-3-5-11(12)14/h3-6,10H,7-9,15H2,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine?
1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine has a molecular weight of 238.76 g/mol, XLogP of 3.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 117020121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).