5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine

C15H15Cl2N5 — CID 10193448

IUPAC5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine
SMILESCC(C)Cn1c(-c2nc(Cl)c(Cl)nc2N)nc2ccccc21
InChIInChI=1S/C15H15Cl2N5/c1-8(2)7-22-10-6-4-3-5-9(10)19-15(22)11-14(18)21-13(17)12(16)20-11/h3-6,8H,7H2,1-2H3,(H2,18,21)
InChIKeyOGPYFRWRZLOABJ-UHFFFAOYSA-N
MW336.23 g/mol
LogP4.04
Rot. Bonds3

About 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine

5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine (PubChem CID 10193448) has the molecular formula C15H15Cl2N5 and a molecular weight of 336.23 g/mol. Its IUPAC name is 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine.

Molecular Properties

Compound Name5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine
PubChem CID10193448
Molecular FormulaC15H15Cl2N5
Molecular Weight336.23 g/mol
Exact Mass335.07
IUPAC Name5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine
SMILESCC(C)Cn1c(-c2nc(Cl)c(Cl)nc2N)nc2ccccc21
InChIInChI=1S/C15H15Cl2N5/c1-8(2)7-22-10-6-4-3-5-9(10)19-15(22)11-14(18)21-13(17)12(16)20-11/h3-6,8H,7H2,1-2H3,(H2,18,21)
InChIKeyOGPYFRWRZLOABJ-UHFFFAOYSA-N
XLogP4.04
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.23
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-2-N-(2-methylpropyl)-5-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazine-2,6-diamine
CID 10150387
5-chloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine
CID 10236520
2-(4-bromophenyl)-1-(2-methylpropyl)benzimidazole
CID 17001122
[1-(2-methylpropyl)benzimidazol-2-yl]methanamine;dihydrochloride
CID 163331235
(1R)-1-[1-(2-methylpropyl)benzimidazol-2-yl]ethanamine;hydrochloride
CID 133143576
6-chloro-1-(2-methylpropyl)-2-phenylbenzimidazole
CID 46310887
2-[[1-(2-methylpropyl)benzimidazol-2-yl]methyl]benzotriazole
CID 5272036
2-(2-chlorophenyl)-1-(2-methylbutyl)benzimidazole
CID 18878777
4-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
CID 53216173
1-(2-methylpropyl)-2-(3-nitrophenyl)benzimidazole
CID 146024319
[5-[1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid
CID 22459964
3-[2-(2-chlorophenyl)benzimidazol-1-yl]-2-methylpropanenitrile
CID 82144793

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine?
The IUPAC name of 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine (CID 10193448) is 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine.
What is the SMILES notation for 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine?
The canonical SMILES for 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine is CC(C)Cn1c(-c2nc(Cl)c(Cl)nc2N)nc2ccccc21.
What is the InChIKey of 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine?
The InChIKey is OGPYFRWRZLOABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N5/c1-8(2)7-22-10-6-4-3-5-9(10)19-15(22)11-14(18)21-13(17)12(16)20-11/h3-6,8H,7H2,1-2H3,(H2,18,21).
What are the key properties of 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine?
5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine has a molecular weight of 336.23 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-3-[1-(2-methylpropyl)benzimidazol-2-yl]pyrazin-2-amine is sourced from PubChem (CID 10193448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).