5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide

C6H12BrN3S — CID 45261548

IUPAC5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide
SMILESBr.Cc1nc(N)sc1CCN
InChIInChI=1S/C6H11N3S.BrH/c1-4-5(2-3-7)10-6(8)9-4;/h2-3,7H2,1H3,(H2,8,9);1H
InChIKeyHNXIGCCEHAYDFJ-UHFFFAOYSA-N
MW238.15 g/mol
LogP1.11
Rot. Bonds2

About 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide

5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide (PubChem CID 45261548) has the molecular formula C6H12BrN3S and a molecular weight of 238.15 g/mol. Its IUPAC name is 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide.

Molecular Properties

Compound Name5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide
PubChem CID45261548
Molecular FormulaC6H12BrN3S
Molecular Weight238.15 g/mol
Exact Mass236.99
IUPAC Name5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide
SMILESBr.Cc1nc(N)sc1CCN
InChIInChI=1S/C6H11N3S.BrH/c1-4-5(2-3-7)10-6(8)9-4;/h2-3,7H2,1H3,(H2,8,9);1H
InChIKeyHNXIGCCEHAYDFJ-UHFFFAOYSA-N
XLogP1.11
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.15
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Amthamine
CID 126688
2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole
CID 10329721
Thiazole, 2-amino-5-(2-chloroethyl)-4-methyl-, monohydrochloride
CID 204190
2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole, (S)-
CID 11521153
2-(Dimethyl-1,3-thiazol-5-yl)ethan-1-amine
CID 15670034
4-Ethyl-5-methyl-1,3-thiazol-2-amine
CID 3164022
4,5,6,7,8,9,10,11,12,13-Decahydrocyclododeca[d][1,3]thiazol-2-amine
CID 950890
Amthamine dihydrobromide
CID 16218912
4-Butyl-5-propyl-1,3-thiazol-2-amine
CID 23585837
(6R)-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine
CID 16743100
5-Methyl-4-(propan-2-yl)-1,3-thiazol-2-amine
CID 21138959
5-(2-Aminoethyl)-4-methyl-1,3-thiazol-2-amine dihydrochloride
CID 88143882

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide?
The IUPAC name of 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide (CID 45261548) is 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide.
What is the SMILES notation for 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide?
The canonical SMILES for 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide is Br.Cc1nc(N)sc1CCN.
What is the InChIKey of 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide?
The InChIKey is HNXIGCCEHAYDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3S.BrH/c1-4-5(2-3-7)10-6(8)9-4;/h2-3,7H2,1H3,(H2,8,9);1H.
What are the key properties of 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide?
5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide has a molecular weight of 238.15 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide is sourced from PubChem (CID 45261548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).