1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine

C12H18N4 — CID 115552143

IUPAC1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine
SMILESCc1cccc2nc(N)n(CCN(C)C)c12
InChIInChI=1S/C12H18N4/c1-9-5-4-6-10-11(9)16(12(13)14-10)8-7-15(2)3/h4-6H,7-8H2,1-3H3,(H2,13,14)
InChIKeyUMDKTMUZWSTWIA-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.49
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine

1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine (PubChem CID 115552143) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine
PubChem CID115552143
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine
SMILESCc1cccc2nc(N)n(CCN(C)C)c12
InChIInChI=1S/C12H18N4/c1-9-5-4-6-10-11(9)16(12(13)14-10)8-7-15(2)3/h4-6H,7-8H2,1-3H3,(H2,13,14)
InChIKeyUMDKTMUZWSTWIA-UHFFFAOYSA-N
XLogP1.49
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methyl-1-(2-methylsulfonylethyl)benzimidazol-2-amine
CID 115552322
1-(3-methoxypropyl)-7-methylbenzimidazol-2-amine
CID 115552278
7-methyl-1-(3-methylsulfonylpropyl)benzimidazol-2-amine
CID 115552409
1-(3-cyclopentylpropyl)-7-methylbenzimidazol-2-amine
CID 106008021
1-[2-(dimethylamino)ethyl]-5,6-dimethylbenzimidazol-2-amine
CID 82359073
2-(2-amino-7-methylbenzimidazol-1-yl)ethyl carbamate
CID 83204061
1-[2-(3,5-difluorophenyl)ethyl]-7-methylbenzimidazol-2-amine
CID 115552468
1-N,1-N,7-trimethylbenzimidazole-1,2-diamine
CID 83017594
1,7-dimethylbenzimidazol-2-amine;ethane
CID 170767427
1-[(4-bromophenyl)methyl]-7-methylbenzimidazol-2-amine
CID 115552239
7-chloro-1-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-2-amine
CID 106419701
3-[2-(2-chloroethyl)-7-methylbenzimidazol-1-yl]-N,N-dimethylpropan-1-amine
CID 115552736

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine (CID 115552143) is 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine is Cc1cccc2nc(N)n(CCN(C)C)c12.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine?
The InChIKey is UMDKTMUZWSTWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-9-5-4-6-10-11(9)16(12(13)14-10)8-7-15(2)3/h4-6H,7-8H2,1-3H3,(H2,13,14).
What are the key properties of 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine?
1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine has a molecular weight of 218.30 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-7-methylbenzimidazol-2-amine is sourced from PubChem (CID 115552143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).