2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide

C15H22N4O2 — CID 103112206

IUPAC2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide
SMILESCCOc1cccc2c1nc(N)n2C(C)C(=O)N(C)CC
InChIInChI=1S/C15H22N4O2/c1-5-18(4)14(20)10(3)19-11-8-7-9-12(21-6-2)13(11)17-15(19)16/h7-10H,5-6H2,1-4H3,(H2,16,17)
InChIKeyGDHONXKFTJACKF-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.06
Rot. Bonds5

About 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide

2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide (PubChem CID 103112206) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide
PubChem CID103112206
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide
SMILESCCOc1cccc2c1nc(N)n2C(C)C(=O)N(C)CC
InChIInChI=1S/C15H22N4O2/c1-5-18(4)14(20)10(3)19-11-8-7-9-12(21-6-2)13(11)17-15(19)16/h7-10H,5-6H2,1-4H3,(H2,16,17)
InChIKeyGDHONXKFTJACKF-UHFFFAOYSA-N
XLogP2.06
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-amino-4-ethoxybenzimidazol-1-yl)-3-methylbutanamide
CID 106346313
2-(2-amino-4-cyanobenzimidazol-1-yl)-N,N-dimethylpropanamide
CID 104718812
2-(5-amino-1-methyl-3-propylimidazo[4,5-d]pyrazol-6-yl)-N-ethyl-N-methylpropanamide
CID 103112220
2-[2-(2-chloroethyl)benzimidazol-1-yl]-N-ethyl-N-methylpropanamide
CID 103112366
2-(5-amino-2-propan-2-ylbenzimidazol-1-yl)-N-ethyl-N-methylpropanamide
CID 103113457
4-ethoxy-1-[(2-methylcyclopropyl)methyl]benzimidazol-2-amine
CID 113463958
2-(2-amino-4-fluorobenzimidazol-1-yl)-N-methylpropanamide
CID 54950785
4-ethoxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]benzimidazol-2-amine
CID 106035762
1-(2-bromo-3-chlorophenyl)-4-ethoxybenzimidazol-2-amine
CID 103480612
2-[(6-ethoxy-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
CID 103111715
1-(1-cyclopropylpropan-2-yl)-4-methoxybenzimidazol-2-amine
CID 113393056
1-(3,3-dimethylbutan-2-yl)-4-propan-2-yloxybenzimidazol-2-amine
CID 104829021

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide (CID 103112206) is 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide is CCOc1cccc2c1nc(N)n2C(C)C(=O)N(C)CC.
What is the InChIKey of 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide?
The InChIKey is GDHONXKFTJACKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-5-18(4)14(20)10(3)19-11-8-7-9-12(21-6-2)13(11)17-15(19)16/h7-10H,5-6H2,1-4H3,(H2,16,17).
What are the key properties of 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide?
2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide has a molecular weight of 290.37 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-ethoxybenzimidazol-1-yl)-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103112206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).