N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine

C19H31N — CID 66475920

IUPACN-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine
SMILESCCNC(c1c(C)cc(C)cc1C)C1C(C)(C)C1(C)C
InChIInChI=1S/C19H31N/c1-9-20-16(17-18(5,6)19(17,7)8)15-13(3)10-12(2)11-14(15)4/h10-11,16-17,20H,9H2,1-8H3
InChIKeyWKWYCVPOSJGKIE-UHFFFAOYSA-N
MW273.46 g/mol
LogP4.94
Rot. Bonds4

About N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine

N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine (PubChem CID 66475920) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine
PubChem CID66475920
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC NameN-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine
SMILESCCNC(c1c(C)cc(C)cc1C)C1C(C)(C)C1(C)C
InChIInChI=1S/C19H31N/c1-9-20-16(17-18(5,6)19(17,7)8)15-13(3)10-12(2)11-14(15)4/h10-11,16-17,20H,9H2,1-8H3
InChIKeyWKWYCVPOSJGKIE-UHFFFAOYSA-N
XLogP4.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine 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-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine?
The IUPAC name of N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine (CID 66475920) is N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine is CCNC(c1c(C)cc(C)cc1C)C1C(C)(C)C1(C)C.
What is the InChIKey of N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine?
The InChIKey is WKWYCVPOSJGKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-9-20-16(17-18(5,6)19(17,7)8)15-13(3)10-12(2)11-14(15)4/h10-11,16-17,20H,9H2,1-8H3.
What are the key properties of N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine?
N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine has a molecular weight of 273.46 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2,3,3-tetramethylcyclopropyl)-(2,4,6-trimethylphenyl)methyl]ethanamine is sourced from PubChem (CID 66475920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).