[1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine

C14H21N — CID 83700838

IUPAC[1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine
SMILESCCc1ccc(C2(CN)CC2(C)C)cc1
InChIInChI=1S/C14H21N/c1-4-11-5-7-12(8-6-11)14(10-15)9-13(14,2)3/h5-8H,4,9-10,15H2,1-3H3
InChIKeyWYZWHHJVZHZEAG-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.88
Rot. Bonds3

About [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine

[1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine (PubChem CID 83700838) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine
PubChem CID83700838
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name[1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine
SMILESCCc1ccc(C2(CN)CC2(C)C)cc1
InChIInChI=1S/C14H21N/c1-4-11-5-7-12(8-6-11)14(10-15)9-13(14,2)3/h5-8H,4,9-10,15H2,1-3H3
InChIKeyWYZWHHJVZHZEAG-UHFFFAOYSA-N
XLogP2.88
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 ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanamine
CID 83705516
[1-(4-ethylphenyl)cyclopentyl]methanamine
CID 82491828
[1-(3,5-dimethylphenyl)-2,2-dimethylcyclopropyl]methanamine
CID 131460343
2-(4-ethylphenyl)-2-methylaziridine
CID 82467898
[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine
CID 83705415
1-(4-ethylphenyl)cycloheptan-1-amine
CID 62544052
1,4-diethylbenzene;ethane
CID 91207141
alumane;1,4-diethylbenzene
CID 174296012
4-(4-ethylphenyl)-4-methyloxane
CID 130287454
5-(aminomethyl)-5-(4-ethylphenyl)-1,3-oxazolidin-2-one
CID 82286284
4-[1-(2,2-dimethylpropyl)-2,2-dimethylcyclopropyl]aniline
CID 89150922
[1-(furan-2-yl)-2,2-dimethylcyclopropyl]methanamine
CID 83480572

Frequently Asked Questions

What is the IUPAC name of [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine?
The IUPAC name of [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine (CID 83700838) is [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine.
What is the SMILES notation for [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine?
The canonical SMILES for [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine is CCc1ccc(C2(CN)CC2(C)C)cc1.
What is the InChIKey of [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine?
The InChIKey is WYZWHHJVZHZEAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-4-11-5-7-12(8-6-11)14(10-15)9-13(14,2)3/h5-8H,4,9-10,15H2,1-3H3.
What are the key properties of [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine?
[1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine has a molecular weight of 203.33 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethylphenyl)-2,2-dimethylcyclopropyl]methanamine is sourced from PubChem (CID 83700838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).