5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide

C4H10BrN3 — CID 71758637

IUPAC5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
SMILESBr.CC1CN=C(N)N1
InChIInChI=1S/C4H9N3.BrH/c1-3-2-6-4(5)7-3;/h3H,2H2,1H3,(H3,5,6,7);1H
InChIKeyPHIXMNQKPSILHJ-UHFFFAOYSA-N
MW180.05 g/mol
LogP-0.13
Rot. Bonds

About 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide

5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide (PubChem CID 71758637) has the molecular formula C4H10BrN3 and a molecular weight of 180.05 g/mol. Its IUPAC name is 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide.

Molecular Properties

Compound Name5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
PubChem CID71758637
Molecular FormulaC4H10BrN3
Molecular Weight180.05 g/mol
Exact Mass179.01
IUPAC Name5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
SMILESBr.CC1CN=C(N)N1
InChIInChI=1S/C4H9N3.BrH/c1-3-2-6-4(5)7-3;/h3H,2H2,1H3,(H3,5,6,7);1H
InChIKeyPHIXMNQKPSILHJ-UHFFFAOYSA-N
XLogP-0.13
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.05
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The IUPAC name of 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide (CID 71758637) is 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide.
What is the SMILES notation for 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The canonical SMILES for 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide is Br.CC1CN=C(N)N1.
What is the InChIKey of 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The InChIKey is PHIXMNQKPSILHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N3.BrH/c1-3-2-6-4(5)7-3;/h3H,2H2,1H3,(H3,5,6,7);1H.
What are the key properties of 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide has a molecular weight of 180.05 g/mol, XLogP of -0.13, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4,5-dihydro-1H-imidazol-2-amine;hydrobromide is sourced from PubChem (CID 71758637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).