1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine

C11H21N3 — CID 106563656

IUPAC1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine
SMILESCCNc1nc(C)cn1CC(C)(C)C
InChIInChI=1S/C11H21N3/c1-6-12-10-13-9(2)7-14(10)8-11(3,4)5/h7H,6,8H2,1-5H3,(H,12,13)
InChIKeyYCFHXPVODZKGLT-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.67
Rot. Bonds3

About 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine

1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine (PubChem CID 106563656) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine
PubChem CID106563656
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine
SMILESCCNc1nc(C)cn1CC(C)(C)C
InChIInChI=1S/C11H21N3/c1-6-12-10-13-9(2)7-14(10)8-11(3,4)5/h7H,6,8H2,1-5H3,(H,12,13)
InChIKeyYCFHXPVODZKGLT-UHFFFAOYSA-N
XLogP2.67
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-butyl-1-(2,2-dimethylpropyl)-4-methylimidazol-2-amine
CID 106563654
1-decyl-N-ethyl-4-methylimidazol-2-amine
CID 106578047
N-ethyl-4-methyl-1-(4,4,4-trifluorobutyl)imidazol-2-amine
CID 106579122
N-ethyl-4-methyl-1-(2-methylsulfinylethyl)imidazol-2-amine
CID 106581380
N-ethyl-4-methyl-1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581055
N-ethyl-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573703
N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine
CID 106571948
1-butan-2-yl-N-ethyl-4-methylimidazol-2-amine
CID 106554895
1-ethyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106554987
N-ethyl-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
CID 106563883
1-[(1,4-dimethylpiperazin-2-yl)methyl]-N-ethyl-4-methylimidazol-2-amine
CID 106574098
1-ethyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557328

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine?
The IUPAC name of 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine (CID 106563656) is 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine.
What is the SMILES notation for 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine?
The canonical SMILES for 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine is CCNc1nc(C)cn1CC(C)(C)C.
What is the InChIKey of 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine?
The InChIKey is YCFHXPVODZKGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-6-12-10-13-9(2)7-14(10)8-11(3,4)5/h7H,6,8H2,1-5H3,(H,12,13).
What are the key properties of 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine?
1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine has a molecular weight of 195.31 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine is sourced from PubChem (CID 106563656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).