2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline

C15H24N2 — CID 107105472

IUPAC2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline
SMILESCc1cccc(CN)c1N(C)C1CCCCC1
InChIInChI=1S/C15H24N2/c1-12-7-6-8-13(11-16)15(12)17(2)14-9-4-3-5-10-14/h6-8,14H,3-5,9-11,16H2,1-2H3
InChIKeyUXKQMITUXMSZNM-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.22
Rot. Bonds3

About 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline

2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline (PubChem CID 107105472) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline
PubChem CID107105472
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline
SMILESCc1cccc(CN)c1N(C)C1CCCCC1
InChIInChI=1S/C15H24N2/c1-12-7-6-8-13(11-16)15(12)17(2)14-9-4-3-5-10-14/h6-8,14H,3-5,9-11,16H2,1-2H3
InChIKeyUXKQMITUXMSZNM-UHFFFAOYSA-N
XLogP3.22
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline?
The IUPAC name of 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline (CID 107105472) is 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline.
What is the SMILES notation for 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline?
The canonical SMILES for 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline is Cc1cccc(CN)c1N(C)C1CCCCC1.
What is the InChIKey of 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline?
The InChIKey is UXKQMITUXMSZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-7-6-8-13(11-16)15(12)17(2)14-9-4-3-5-10-14/h6-8,14H,3-5,9-11,16H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline?
2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline has a molecular weight of 232.37 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclohexyl-N,6-dimethylaniline is sourced from PubChem (CID 107105472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).