(5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide

C5H13BrN4 — CID 44571822

IUPAC(5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
SMILESBr.NCC[C@@H]1CN=C(N)N1
InChIInChI=1S/C5H12N4.BrH/c6-2-1-4-3-8-5(7)9-4;/h4H,1-3,6H2,(H3,7,8,9);1H/t4-;/m1./s1
InChIKeyGAJWZZKBCYSCQL-PGMHMLKASA-N
MW209.09 g/mol
LogP-0.80
Rot. Bonds2

About (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide

(5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide (PubChem CID 44571822) has the molecular formula C5H13BrN4 and a molecular weight of 209.09 g/mol. Its IUPAC name is (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide.

Molecular Properties

Compound Name(5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
PubChem CID44571822
Molecular FormulaC5H13BrN4
Molecular Weight209.09 g/mol
Exact Mass208.03
IUPAC Name(5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
SMILESBr.NCC[C@@H]1CN=C(N)N1
InChIInChI=1S/C5H12N4.BrH/c6-2-1-4-3-8-5(7)9-4;/h4H,1-3,6H2,(H3,7,8,9);1H/t4-;/m1./s1
InChIKeyGAJWZZKBCYSCQL-PGMHMLKASA-N
XLogP-0.80
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.09
LogP ≤ 5-0.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The IUPAC name of (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide (CID 44571822) is (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide.
What is the SMILES notation for (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The canonical SMILES for (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide is Br.NCC[C@@H]1CN=C(N)N1.
What is the InChIKey of (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The InChIKey is GAJWZZKBCYSCQL-PGMHMLKASA-N. The full InChI is InChI=1S/C5H12N4.BrH/c6-2-1-4-3-8-5(7)9-4;/h4H,1-3,6H2,(H3,7,8,9);1H/t4-;/m1./s1.
What are the key properties of (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
(5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide has a molecular weight of 209.09 g/mol, XLogP of -0.80, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide is sourced from PubChem (CID 44571822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).