N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide

C11H22N4O — CID 59945498

IUPACN-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide
SMILESCC(=O)NCCN(C)CCN1CCN=C1C
InChIInChI=1S/C11H22N4O/c1-10-12-5-7-15(10)9-8-14(3)6-4-13-11(2)16/h4-9H2,1-3H3,(H,13,16)
InChIKeySGRKZLCZYUIFAI-UHFFFAOYSA-N
MW226.32 g/mol
LogP-0.21
Rot. Bonds6

About N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide

N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide (PubChem CID 59945498) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide
PubChem CID59945498
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC NameN-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide
SMILESCC(=O)NCCN(C)CCN1CCN=C1C
InChIInChI=1S/C11H22N4O/c1-10-12-5-7-15(10)9-8-14(3)6-4-13-11(2)16/h4-9H2,1-3H3,(H,13,16)
InChIKeySGRKZLCZYUIFAI-UHFFFAOYSA-N
XLogP-0.21
TPSA47.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide?
The IUPAC name of N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide (CID 59945498) is N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide.
What is the SMILES notation for N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide?
The canonical SMILES for N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide is CC(=O)NCCN(C)CCN1CCN=C1C.
What is the InChIKey of N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide?
The InChIKey is SGRKZLCZYUIFAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-10-12-5-7-15(10)9-8-14(3)6-4-13-11(2)16/h4-9H2,1-3H3,(H,13,16).
What are the key properties of N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide?
N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide has a molecular weight of 226.32 g/mol, XLogP of -0.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methyl-[2-(2-methyl-4,5-dihydroimidazol-1-yl)ethyl]amino]ethyl]acetamide is sourced from PubChem (CID 59945498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).