2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine

C11H23NO — CID 167210471

IUPAC2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine
SMILESCNC1C(COC)C1CC(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)6-8-9(7-13-5)10(8)12-4/h8-10,12H,6-7H2,1-5H3
InChIKeyCLPJYZUCSXSZQE-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.90
Rot. Bonds4

About 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine

2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine (PubChem CID 167210471) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine
PubChem CID167210471
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine
SMILESCNC1C(COC)C1CC(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)6-8-9(7-13-5)10(8)12-4/h8-10,12H,6-7H2,1-5H3
InChIKeyCLPJYZUCSXSZQE-UHFFFAOYSA-N
XLogP1.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-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 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine?
The IUPAC name of 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine (CID 167210471) is 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine?
The canonical SMILES for 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine is CNC1C(COC)C1CC(C)(C)C.
What is the InChIKey of 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine?
The InChIKey is CLPJYZUCSXSZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-11(2,3)6-8-9(7-13-5)10(8)12-4/h8-10,12H,6-7H2,1-5H3.
What are the key properties of 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine?
2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-3-(methoxymethyl)-N-methylcyclopropan-1-amine is sourced from PubChem (CID 167210471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).