4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine

C12H23N3 — CID 106570359

IUPAC4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine
SMILESCCC(C)Cn1cc(C)nc1NC(C)C
InChIInChI=1S/C12H23N3/c1-6-10(4)7-15-8-11(5)14-12(15)13-9(2)3/h8-10H,6-7H2,1-5H3,(H,13,14)
InChIKeyLODVLVBIYGMLJO-UHFFFAOYSA-N
MW209.34 g/mol
LogP3.06
Rot. Bonds5

About 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine

4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine (PubChem CID 106570359) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine
PubChem CID106570359
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine
SMILESCCC(C)Cn1cc(C)nc1NC(C)C
InChIInChI=1S/C12H23N3/c1-6-10(4)7-15-8-11(5)14-12(15)13-9(2)3/h8-10H,6-7H2,1-5H3,(H,13,14)
InChIKeyLODVLVBIYGMLJO-UHFFFAOYSA-N
XLogP3.06
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxy-2-methylpropyl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106566653
4-methyl-N-propan-2-yl-1-(2-pyrrolidin-1-ylethyl)imidazol-2-amine
CID 106570264
1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106578976
1-ethyl-4-methyl-N-(2-methylpentan-3-yl)imidazol-2-amine
CID 106564923
4-methyl-N-propan-2-yl-1-(3-propoxypropyl)imidazol-2-amine
CID 106578561
4-methyl-1-(2-methylpropyl)-N-(1-piperidin-1-ylpropan-2-yl)imidazol-2-amine
CID 106569158
N-heptan-2-yl-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106568866
4-methyl-1-prop-2-enyl-N-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-2-amine
CID 106567600
4-methyl-1-(2-methylpropyl)-N-octan-2-ylimidazol-2-amine
CID 106564935
1-(2-cyclopentyloxyethyl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106573164
4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine
CID 106569605
1-(4-ethylsulfanylbutan-2-yl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106582849

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine?
The IUPAC name of 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine (CID 106570359) is 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine?
The canonical SMILES for 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine is CCC(C)Cn1cc(C)nc1NC(C)C.
What is the InChIKey of 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine?
The InChIKey is LODVLVBIYGMLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-6-10(4)7-15-8-11(5)14-12(15)13-9(2)3/h8-10H,6-7H2,1-5H3,(H,13,14).
What are the key properties of 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine?
4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine has a molecular weight of 209.34 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106570359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).