1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine

C16H26N4 — CID 82333992

IUPAC1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine
SMILESCC(C)c1ccc2c(c1)nc(C(C)N)n2CCN(C)C
InChIInChI=1S/C16H26N4/c1-11(2)13-6-7-15-14(10-13)18-16(12(3)17)20(15)9-8-19(4)5/h6-7,10-12H,8-9,17H2,1-5H3
InChIKeyLEFTZWHLNNBPGD-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.74
Rot. Bonds5

About 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine

1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine (PubChem CID 82333992) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine
PubChem CID82333992
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine
SMILESCC(C)c1ccc2c(c1)nc(C(C)N)n2CCN(C)C
InChIInChI=1S/C16H26N4/c1-11(2)13-6-7-15-14(10-13)18-16(12(3)17)20(15)9-8-19(4)5/h6-7,10-12H,8-9,17H2,1-5H3
InChIKeyLEFTZWHLNNBPGD-UHFFFAOYSA-N
XLogP2.74
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(1-chloroethyl)-5-propan-2-ylbenzimidazol-1-yl]-N,N-dimethylethanamine
CID 82334199
1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]propan-1-amine
CID 82334045
2-[2-(aminomethyl)-5-propan-2-ylbenzimidazol-1-yl]-N,N-dimethylethanamine
CID 82333974
1-[1-(2-methylprop-2-enyl)-5-propan-2-ylbenzimidazol-2-yl]ethanamine
CID 82333991
2-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]acetic acid
CID 82333901
1-[1,5-di(propan-2-yl)benzimidazol-2-yl]ethanamine
CID 82333985
2-[2-(1-chloroethyl)-5-ethylbenzimidazol-1-yl]-N,N-dimethylethanamine
CID 82333823
1-[1-[2-(dimethylamino)ethyl]-2-propan-2-ylbenzimidazol-5-yl]ethanone
CID 94743219
2-[2-(1-chloroethyl)-5-(trifluoromethyl)benzimidazol-1-yl]-N,N-dimethylethanamine
CID 115502152
2-[1-[2-(dimethylamino)ethyl]-2-propan-2-ylbenzimidazol-5-yl]acetic acid
CID 82142232
1-[2-[methyl(propan-2-yl)amino]ethyl]-2-propan-2-ylbenzimidazol-5-amine
CID 62640082
1-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)ethanamine
CID 82493456

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine?
The IUPAC name of 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine (CID 82333992) is 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine.
What is the SMILES notation for 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine?
The canonical SMILES for 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine is CC(C)c1ccc2c(c1)nc(C(C)N)n2CCN(C)C.
What is the InChIKey of 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine?
The InChIKey is LEFTZWHLNNBPGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-11(2)13-6-7-15-14(10-13)18-16(12(3)17)20(15)9-8-19(4)5/h6-7,10-12H,8-9,17H2,1-5H3.
What are the key properties of 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine?
1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine has a molecular weight of 274.41 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(dimethylamino)ethyl]-5-propan-2-ylbenzimidazol-2-yl]ethanamine is sourced from PubChem (CID 82333992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).