1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine

C10H19N3S — CID 117193170

IUPAC1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine
SMILESCC(C)SCc1cnc(N)n1C(C)C
InChIInChI=1S/C10H19N3S/c1-7(2)13-9(5-12-10(13)11)6-14-8(3)4/h5,7-8H,6H2,1-4H3,(H2,11,12)
InChIKeyAYZSUPATXXLEQE-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.69
Rot. Bonds4

About 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine

1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine (PubChem CID 117193170) has the molecular formula C10H19N3S and a molecular weight of 213.35 g/mol. Its IUPAC name is 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine.

Molecular Properties

Compound Name1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine
PubChem CID117193170
Molecular FormulaC10H19N3S
Molecular Weight213.35 g/mol
Exact Mass213.13
IUPAC Name1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine
SMILESCC(C)SCc1cnc(N)n1C(C)C
InChIInChI=1S/C10H19N3S/c1-7(2)13-9(5-12-10(13)11)6-14-8(3)4/h5,7-8H,6H2,1-4H3,(H2,11,12)
InChIKeyAYZSUPATXXLEQE-UHFFFAOYSA-N
XLogP2.69
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-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

1-propan-2-yl-5-(propan-2-yloxymethyl)imidazol-2-amine
CID 117193169
5-(piperidin-1-ylmethyl)-1-propan-2-ylimidazol-2-amine
CID 117192935
5-[(cyclopentylamino)methyl]-1-propan-2-ylimidazol-2-amine
CID 117192903
1-ethyl-2-methyl-5-(propan-2-ylsulfanylmethyl)imidazole
CID 117193132
(2-bromo-3-propan-2-ylimidazol-4-yl)methanamine
CID 117192918
1-ethyl-5-(ethylsulfanylmethyl)imidazol-2-amine
CID 117193137
2-ethyl-5-(propan-2-ylsulfanylmethyl)pyridine
CID 158668941
4-propan-2-yl-5-[(3-propan-2-ylimidazol-4-yl)methylsulfanyl]-1,2,4-triazol-3-amine
CID 66153258
4-propan-2-yl-5-(pyrazin-2-ylmethylsulfanyl)-1,2,4-triazol-3-amine
CID 63096477
2-(propan-2-ylsulfanylmethyl)pyrimidine-5-carbaldehyde
CID 65133714
N-methyl-3-(propan-2-ylsulfanylmethyl)pyridin-2-amine
CID 62467144
1-propan-2-yl-2-(propan-2-ylsulfanylmethyl)indole-6-carboxylic acid
CID 117180925

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine?
The IUPAC name of 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine (CID 117193170) is 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine.
What is the SMILES notation for 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine?
The canonical SMILES for 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine is CC(C)SCc1cnc(N)n1C(C)C.
What is the InChIKey of 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine?
The InChIKey is AYZSUPATXXLEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3S/c1-7(2)13-9(5-12-10(13)11)6-14-8(3)4/h5,7-8H,6H2,1-4H3,(H2,11,12).
What are the key properties of 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine?
1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine has a molecular weight of 213.35 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-5-(propan-2-ylsulfanylmethyl)imidazol-2-amine is sourced from PubChem (CID 117193170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).