N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine

C18H30N2 — CID 43665344

IUPACN-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1Nc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H30N2/c1-13-12-20(6)14(2)11-17(13)19-16-9-7-15(8-10-16)18(3,4)5/h7-10,13-14,17,19H,11-12H2,1-6H3
InChIKeyWPDHTRPHYYDOTB-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.12
Rot. Bonds2

About N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine

N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 43665344) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID43665344
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1Nc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H30N2/c1-13-12-20(6)14(2)11-17(13)19-16-9-7-15(8-10-16)18(3,4)5/h7-10,13-14,17,19H,11-12H2,1-6H3
InChIKeyWPDHTRPHYYDOTB-UHFFFAOYSA-N
XLogP4.12
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-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

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine (CID 43665344) is N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine is CC1CN(C)C(C)CC1Nc1ccc(C(C)(C)C)cc1.
What is the InChIKey of N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is WPDHTRPHYYDOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-13-12-20(6)14(2)11-17(13)19-16-9-7-15(8-10-16)18(3,4)5/h7-10,13-14,17,19H,11-12H2,1-6H3.
What are the key properties of N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine?
N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 274.45 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 43665344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).