2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine

C14H21N — CID 82282694

IUPAC2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine
SMILESCc1cc(C)c(C(CN)C2CC2)cc1C
InChIInChI=1S/C14H21N/c1-9-6-11(3)13(7-10(9)2)14(8-15)12-4-5-12/h6-7,12,14H,4-5,8,15H2,1-3H3
InChIKeyMDLIXIYEVNVREJ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.06
Rot. Bonds3

About 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine

2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine (PubChem CID 82282694) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine
PubChem CID82282694
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine
SMILESCc1cc(C)c(C(CN)C2CC2)cc1C
InChIInChI=1S/C14H21N/c1-9-6-11(3)13(7-10(9)2)14(8-15)12-4-5-12/h6-7,12,14H,4-5,8,15H2,1-3H3
InChIKeyMDLIXIYEVNVREJ-UHFFFAOYSA-N
XLogP3.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-chloro-4-methoxy-2-methylphenyl)-2-cyclopentylethanamine
CID 82304977
2-cyclopentyl-2-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)ethanamine
CID 82500943
2-cyclopropyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990610
2-(4-chloro-2-methylphenyl)-2-cyclopentylethanamine
CID 83824559
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(2,4,5-trimethylphenyl)methanamine
CID 115998020
2-(2-methoxy-4,5-dimethylphenyl)-2-(3-methylcyclohexyl)ethanamine
CID 83974856
2-(2,4-dimethylphenyl)-2-(1-propylpiperidin-4-yl)ethanamine
CID 83972813
2-cyclopropyl-2-(4-fluoro-3-methylphenyl)ethanamine
CID 55269434
3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine
CID 82076833
2-ethyl-1-(2,4,5-trimethylphenyl)propane-1,3-diamine
CID 116945487
1-(2-bromo-1-cyclopropylethyl)-2-methoxy-4,5-dimethylbenzene
CID 82094018
4-[methylamino-(2,4,5-trimethylphenyl)methyl]cyclohexan-1-amine
CID 116952300

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine?
The IUPAC name of 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine (CID 82282694) is 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine?
The canonical SMILES for 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine is Cc1cc(C)c(C(CN)C2CC2)cc1C.
What is the InChIKey of 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine?
The InChIKey is MDLIXIYEVNVREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-9-6-11(3)13(7-10(9)2)14(8-15)12-4-5-12/h6-7,12,14H,4-5,8,15H2,1-3H3.
What are the key properties of 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine?
2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine has a molecular weight of 203.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine is sourced from PubChem (CID 82282694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).