5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine

C8H17N3 — CID 59669454

IUPAC5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)(C)CC1CN=C(N)N1
InChIInChI=1S/C8H17N3/c1-8(2,3)4-6-5-10-7(9)11-6/h6H,4-5H2,1-3H3,(H3,9,10,11)
InChIKeyLLUNGPRZACPDSE-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.71
Rot. Bonds1

About 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine

5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 59669454) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID59669454
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)(C)CC1CN=C(N)N1
InChIInChI=1S/C8H17N3/c1-8(2,3)4-6-5-10-7(9)11-6/h6H,4-5H2,1-3H3,(H3,9,10,11)
InChIKeyLLUNGPRZACPDSE-UHFFFAOYSA-N
XLogP0.71
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine (CID 59669454) is 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine is CC(C)(C)CC1CN=C(N)N1.
What is the InChIKey of 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is LLUNGPRZACPDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-8(2,3)4-6-5-10-7(9)11-6/h6H,4-5H2,1-3H3,(H3,9,10,11).
What are the key properties of 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine?
5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 155.24 g/mol, XLogP of 0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-dimethylpropyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 59669454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).