N,4-dimethyl-2,6-di(propan-2-yl)aniline

C14H23N — CID 154688627

IUPACN,4-dimethyl-2,6-di(propan-2-yl)aniline
SMILESCNc1c(C(C)C)cc(C)cc1C(C)C
InChIInChI=1S/C14H23N/c1-9(2)12-7-11(5)8-13(10(3)4)14(12)15-6/h7-10,15H,1-6H3
InChIKeyXHCFQYWOWYNXAK-UHFFFAOYSA-N
MW205.34 g/mol
LogP4.28
Rot. Bonds3

About N,4-dimethyl-2,6-di(propan-2-yl)aniline

N,4-dimethyl-2,6-di(propan-2-yl)aniline (PubChem CID 154688627) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N,4-dimethyl-2,6-di(propan-2-yl)aniline.

Molecular Properties

Compound NameN,4-dimethyl-2,6-di(propan-2-yl)aniline
PubChem CID154688627
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN,4-dimethyl-2,6-di(propan-2-yl)aniline
SMILESCNc1c(C(C)C)cc(C)cc1C(C)C
InChIInChI=1S/C14H23N/c1-9(2)12-7-11(5)8-13(10(3)4)14(12)15-6/h7-10,15H,1-6H3
InChIKeyXHCFQYWOWYNXAK-UHFFFAOYSA-N
XLogP4.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N,4-dimethyl-2,6-di(propan-2-yl)aniline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2,6-di(propan-2-yl)aniline?
The IUPAC name of N,4-dimethyl-2,6-di(propan-2-yl)aniline (CID 154688627) is N,4-dimethyl-2,6-di(propan-2-yl)aniline.
What is the SMILES notation for N,4-dimethyl-2,6-di(propan-2-yl)aniline?
The canonical SMILES for N,4-dimethyl-2,6-di(propan-2-yl)aniline is CNc1c(C(C)C)cc(C)cc1C(C)C.
What is the InChIKey of N,4-dimethyl-2,6-di(propan-2-yl)aniline?
The InChIKey is XHCFQYWOWYNXAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-9(2)12-7-11(5)8-13(10(3)4)14(12)15-6/h7-10,15H,1-6H3.
What are the key properties of N,4-dimethyl-2,6-di(propan-2-yl)aniline?
N,4-dimethyl-2,6-di(propan-2-yl)aniline has a molecular weight of 205.34 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2,6-di(propan-2-yl)aniline is sourced from PubChem (CID 154688627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).