1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine

C11H21N3 — CID 83143894

IUPAC1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine
SMILESCC(CNc1nccn1C)C(C)(C)C
InChIInChI=1S/C11H21N3/c1-9(11(2,3)4)8-13-10-12-6-7-14(10)5/h6-7,9H,8H2,1-5H3,(H,12,13)
InChIKeyVCKSZBAFEXBQMW-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.51
Rot. Bonds3

About 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine

1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine (PubChem CID 83143894) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine.

Molecular Properties

Compound Name1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine
PubChem CID83143894
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine
SMILESCC(CNc1nccn1C)C(C)(C)C
InChIInChI=1S/C11H21N3/c1-9(11(2,3)4)8-13-10-12-6-7-14(10)5/h6-7,9H,8H2,1-5H3,(H,12,13)
InChIKeyVCKSZBAFEXBQMW-UHFFFAOYSA-N
XLogP2.51
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 ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylpropyl)-1-methylimidazol-2-amine
CID 65037048
3-[(1-methylimidazol-2-yl)amino]propane-1,2-diol
CID 66177126
2-methyl-1-[(1-methylimidazol-2-yl)amino]propan-2-ol
CID 65108978
2-methyl-4-[(1-methylimidazol-2-yl)amino]butanoic acid
CID 80539688
1-methyl-N-pentan-3-ylimidazol-2-amine
CID 62132399
2-[(1-methylimidazol-2-yl)amino]-N-propan-2-ylacetamide
CID 62133098
1-N,1-N-dimethyl-2-N-(1-methylimidazol-2-yl)propane-1,2-diamine
CID 82937558
1-methyl-N-(2-methyl-2-methylsulfonylpropyl)imidazol-2-amine
CID 79561930
1-cyclopropyl-3-(2,3,3-trimethylbutylamino)pyrazin-2-one
CID 83144354
6-N-methyl-8-N-(2,3,3-trimethylbutyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 83147491
N-[1-(4-bromophenyl)ethyl]-1-methylimidazol-2-amine
CID 62133310
1-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]imidazol-2-amine
CID 106430806

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine?
The IUPAC name of 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine (CID 83143894) is 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine.
What is the SMILES notation for 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine?
The canonical SMILES for 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine is CC(CNc1nccn1C)C(C)(C)C.
What is the InChIKey of 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine?
The InChIKey is VCKSZBAFEXBQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-9(11(2,3)4)8-13-10-12-6-7-14(10)5/h6-7,9H,8H2,1-5H3,(H,12,13).
What are the key properties of 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine?
1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine has a molecular weight of 195.31 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine is sourced from PubChem (CID 83143894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).