2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine

C11H21N3 — CID 61493565

IUPAC2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
SMILESCc1nccn1CCNCC(C)(C)C
InChIInChI=1S/C11H21N3/c1-10-13-6-8-14(10)7-5-12-9-11(2,3)4/h6,8,12H,5,7,9H2,1-4H3
InChIKeyFCJQOIZRGFMOFK-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.83
Rot. Bonds4

About 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine

2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine (PubChem CID 61493565) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
PubChem CID61493565
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
SMILESCc1nccn1CCNCC(C)(C)C
InChIInChI=1S/C11H21N3/c1-10-13-6-8-14(10)7-5-12-9-11(2,3)4/h6,8,12H,5,7,9H2,1-4H3
InChIKeyFCJQOIZRGFMOFK-UHFFFAOYSA-N
XLogP1.83
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-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

Related Compounds

2-methoxy-2-methyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
CID 104760515
2-methyl-1-[2-(2-methylimidazol-1-yl)ethylamino]-3-methylsulfanylpropan-2-ol
CID 106247158
5-chloro-N-[2-(2-methylimidazol-1-yl)ethyl]pentan-1-amine
CID 107319925
3-methyl-N-[2-(2-methylimidazol-1-yl)ethyl]-2-propan-2-ylbutan-1-amine
CID 102905476
N-[2-(2-methylimidazol-1-yl)ethyl]pentan-1-amine
CID 61492853
2-(2-methylimidazol-1-yl)-N-[2-(trifluoromethylsulfanyl)ethyl]ethanamine
CID 106429372
2,2-dimethyl-3-(2-methylimidazol-1-yl)-N-propylpropan-1-amine
CID 79620191
6-iodo-N-[2-(2-methylimidazol-1-yl)ethyl]hexan-1-amine
CID 107844722
5-[2-(2-methylimidazol-1-yl)ethylamino]pentan-1-ol
CID 107317411
1-(5,5-dimethylhexyl)-2-methylimidazole
CID 168848889
4-methyl-N-[2-(2-methylimidazol-1-yl)ethyl]aniline
CID 61493258
N-[(1-methylcyclopentyl)methyl]-2-(2-methylimidazol-1-yl)ethanamine
CID 63821869

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine?
The IUPAC name of 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine (CID 61493565) is 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine is Cc1nccn1CCNCC(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine?
The InChIKey is FCJQOIZRGFMOFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-10-13-6-8-14(10)7-5-12-9-11(2,3)4/h6,8,12H,5,7,9H2,1-4H3.
What are the key properties of 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine?
2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine has a molecular weight of 195.31 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]propan-1-amine is sourced from PubChem (CID 61493565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).