5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine

C11H17BrN4S — CID 115381623

IUPAC5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine
SMILESCN(C)CCN1C(N)=NCC1c1sccc1Br
InChIInChI=1S/C11H17BrN4S/c1-15(2)4-5-16-9(7-14-11(16)13)10-8(12)3-6-17-10/h3,6,9H,4-5,7H2,1-2H3,(H2,13,14)
InChIKeyHSWCFVJBSYHAMX-UHFFFAOYSA-N
MW317.26 g/mol
LogP1.74
Rot. Bonds4

About 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine

5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine (PubChem CID 115381623) has the molecular formula C11H17BrN4S and a molecular weight of 317.26 g/mol. Its IUPAC name is 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine
PubChem CID115381623
Molecular FormulaC11H17BrN4S
Molecular Weight317.26 g/mol
Exact Mass316.04
IUPAC Name5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine
SMILESCN(C)CCN1C(N)=NCC1c1sccc1Br
InChIInChI=1S/C11H17BrN4S/c1-15(2)4-5-16-9(7-14-11(16)13)10-8(12)3-6-17-10/h3,6,9H,4-5,7H2,1-2H3,(H2,13,14)
InChIKeyHSWCFVJBSYHAMX-UHFFFAOYSA-N
XLogP1.74
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-5-(3-methylthiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 79510507
1-(3-bromophenyl)-5-(3-bromothiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 115381645
1-[2-(dimethylamino)ethyl]-5-ethyl-4,5-dihydroimidazol-2-amine
CID 79498201
1-[2-(diethylamino)ethyl]-5-(5-methylthiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 79515135
5-(4,5-dibromothiophen-2-yl)-1-(thiophen-2-ylmethyl)-4,5-dihydroimidazol-2-amine
CID 102845822
5-(5-bromothiophen-2-yl)-1-ethyl-4,5-dihydroimidazol-2-amine
CID 79509949
1-butan-2-yl-5-(3-methylthiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 79514744
2-(3-bromothiophen-2-yl)-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine
CID 115380421
[2-(3-bromothiophen-2-yl)-1-methylazepan-3-yl]methanamine
CID 115381356
5-(2-bromophenyl)-1-(cyclopropylmethyl)-4,5-dihydroimidazol-2-amine
CID 79520981
1-[2-(diethylamino)ethyl]-5-(2,4-difluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79501998
5-(7-bromo-1,3-benzodioxol-5-yl)-1-propyl-4,5-dihydroimidazol-2-amine
CID 79510062

Frequently Asked Questions

What is the IUPAC name of 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine (CID 115381623) is 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine is CN(C)CCN1C(N)=NCC1c1sccc1Br.
What is the InChIKey of 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The InChIKey is HSWCFVJBSYHAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN4S/c1-15(2)4-5-16-9(7-14-11(16)13)10-8(12)3-6-17-10/h3,6,9H,4-5,7H2,1-2H3,(H2,13,14).
What are the key properties of 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine has a molecular weight of 317.26 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-bromothiophen-2-yl)-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 115381623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).