N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide

C16H24N4O — CID 115574820

IUPACN,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide
SMILESCCN(CC)C(=O)CNCc1nc2ccccc2n1CC
InChIInChI=1S/C16H24N4O/c1-4-19(5-2)16(21)12-17-11-15-18-13-9-7-8-10-14(13)20(15)6-3/h7-10,17H,4-6,11-12H2,1-3H3
InChIKeyVAZBCHKFOJTNNF-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.01
Rot. Bonds7

About N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide

N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide (PubChem CID 115574820) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide
PubChem CID115574820
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide
SMILESCCN(CC)C(=O)CNCc1nc2ccccc2n1CC
InChIInChI=1S/C16H24N4O/c1-4-19(5-2)16(21)12-17-11-15-18-13-9-7-8-10-14(13)20(15)6-3/h7-10,17H,4-6,11-12H2,1-3H3
InChIKeyVAZBCHKFOJTNNF-UHFFFAOYSA-N
XLogP2.01
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-ethylbenzimidazol-2-yl)methylamino]-N-methylacetamide
CID 60673139
1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine
CID 43655424
N-[[1-[2-(diethylamino)-2-oxoethyl]benzimidazol-2-yl]methyl]-2,2-dimethylpropanamide
CID 16969582
1-(ethylamino)-3-(1-ethylbenzimidazol-2-yl)propan-2-one
CID 116562664
1,3-bis(1-ethylbenzimidazol-2-yl)propan-2-one
CID 91072390
(1-ethylbenzimidazol-2-yl)methylhydrazine
CID 53275104
N-[(1-ethylbenzimidazol-2-yl)methyl]-2,2-difluoroethanamine
CID 113303573
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methylsulfonylethanamine
CID 47145524
N-[(1-ethylbenzimidazol-2-yl)methyl]-3,3-dimethylbutan-1-amine
CID 115574819
2-[2-[(1-ethylbenzimidazol-2-yl)methylamino]ethoxy]ethanol
CID 54906324
N-[(1-ethylbenzimidazol-2-yl)methyl]cyclopropanecarboxamide
CID 16969775
1-(1-ethylbenzimidazol-2-yl)-3-(propylamino)propan-2-one
CID 116562942

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide?
The IUPAC name of N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide (CID 115574820) is N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide.
What is the SMILES notation for N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide?
The canonical SMILES for N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide is CCN(CC)C(=O)CNCc1nc2ccccc2n1CC.
What is the InChIKey of N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide?
The InChIKey is VAZBCHKFOJTNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-4-19(5-2)16(21)12-17-11-15-18-13-9-7-8-10-14(13)20(15)6-3/h7-10,17H,4-6,11-12H2,1-3H3.
What are the key properties of N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide?
N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide has a molecular weight of 288.39 g/mol, XLogP of 2.01, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(1-ethylbenzimidazol-2-yl)methylamino]acetamide is sourced from PubChem (CID 115574820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).