6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine

C14H19ClN4 — CID 83018887

IUPAC6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine
SMILESCC1CCCC(C)N1n1c(N)nc2ccc(Cl)cc21
InChIInChI=1S/C14H19ClN4/c1-9-4-3-5-10(2)18(9)19-13-8-11(15)6-7-12(13)17-14(19)16/h6-10H,3-5H2,1-2H3,(H2,16,17)
InChIKeyJZONPCZGOGCAFI-UHFFFAOYSA-N
MW278.79 g/mol
LogP3.17
Rot. Bonds1

About 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine

6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine (PubChem CID 83018887) has the molecular formula C14H19ClN4 and a molecular weight of 278.79 g/mol. Its IUPAC name is 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine.

Molecular Properties

Compound Name6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine
PubChem CID83018887
Molecular FormulaC14H19ClN4
Molecular Weight278.79 g/mol
Exact Mass278.13
IUPAC Name6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine
SMILESCC1CCCC(C)N1n1c(N)nc2ccc(Cl)cc21
InChIInChI=1S/C14H19ClN4/c1-9-4-3-5-10(2)18(9)19-13-8-11(15)6-7-12(13)17-14(19)16/h6-10H,3-5H2,1-2H3,(H2,16,17)
InChIKeyJZONPCZGOGCAFI-UHFFFAOYSA-N
XLogP3.17
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.79
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-1-methyl-1H-1,3-benzodiazol-2-amine
CID 113622
6-chloro-1-methyl-1H-1,3-benzodiazol-2-amine
CID 10419809
1H-Benzimidazole, 5-chloro-1-ethyl-2-methyl-
CID 76064
5-Chloro-1-(phenylmethyl)-2-piperazin-1-ylbenzimidazole
CID 10806082
5-Chloro-1,2-dimethyl-1H-benzimidazole
CID 13032420
7-chloro-1-methyl-1H-1,3-benzodiazol-2-amine
CID 43661428
5-Chloro-2-guanidinobenzimidazole
CID 408159
6-Chloro-1,3-diethyl-2-[2-(methyl-phenyl-amino)-vinyl]-3H-benzoimidazol-1-ium
CID 5719371
N-(3-chlorophenyl)-1-methyl-1H-1,3-benzodiazol-2-amine
CID 923804
3-Amino-7-chloro-1,2,4-benzotriazine
CID 95001
6-chloro-1,2-dimethyl-1H-benzo[d]imidazole
CID 315498
2-[[4-(4-Chlorophenyl)piperazin-1-yl]methyl]-1-methylbenzimidazole
CID 798232

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine?
The IUPAC name of 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine (CID 83018887) is 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine.
What is the SMILES notation for 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine?
The canonical SMILES for 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine is CC1CCCC(C)N1n1c(N)nc2ccc(Cl)cc21.
What is the InChIKey of 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine?
The InChIKey is JZONPCZGOGCAFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN4/c1-9-4-3-5-10(2)18(9)19-13-8-11(15)6-7-12(13)17-14(19)16/h6-10H,3-5H2,1-2H3,(H2,16,17).
What are the key properties of 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine?
6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine has a molecular weight of 278.79 g/mol, XLogP of 3.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1-(2,6-dimethylpiperidin-1-yl)benzimidazol-2-amine is sourced from PubChem (CID 83018887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).