N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide

C10H23IN4O — CID 120970734

IUPACN'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide
SMILESCOCCN(C)CCNC1=NCCN1C.I
InChIInChI=1S/C10H22N4O.HI/c1-13(8-9-15-3)6-4-11-10-12-5-7-14(10)2;/h4-9H2,1-3H3,(H,11,12);1H
InChIKeyACILIFIEWURMSV-UHFFFAOYSA-N
MW342.23 g/mol
LogP0.07
Rot. Bonds6

About N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide

N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide (PubChem CID 120970734) has the molecular formula C10H23IN4O and a molecular weight of 342.23 g/mol. Its IUPAC name is N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide.

Molecular Properties

Compound NameN'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide
PubChem CID120970734
Molecular FormulaC10H23IN4O
Molecular Weight342.23 g/mol
Exact Mass342.09
IUPAC NameN'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide
SMILESCOCCN(C)CCNC1=NCCN1C.I
InChIInChI=1S/C10H22N4O.HI/c1-13(8-9-15-3)6-4-11-10-12-5-7-14(10)2;/h4-9H2,1-3H3,(H,11,12);1H
InChIKeyACILIFIEWURMSV-UHFFFAOYSA-N
XLogP0.07
TPSA40.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.23
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide?
The IUPAC name of N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide (CID 120970734) is N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide.
What is the SMILES notation for N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide?
The canonical SMILES for N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide is COCCN(C)CCNC1=NCCN1C.I.
What is the InChIKey of N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide?
The InChIKey is ACILIFIEWURMSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O.HI/c1-13(8-9-15-3)6-4-11-10-12-5-7-14(10)2;/h4-9H2,1-3H3,(H,11,12);1H.
What are the key properties of N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide?
N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide has a molecular weight of 342.23 g/mol, XLogP of 0.07, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide is sourced from PubChem (CID 120970734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).