N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine

C16H16Cl2N4O — CID 56610280

IUPACN-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine
SMILESCc1ccnc(CON2CCN=C2Nc2c(Cl)cccc2Cl)c1
InChIInChI=1S/C16H16Cl2N4O/c1-11-5-6-19-12(9-11)10-23-22-8-7-20-16(22)21-15-13(17)3-2-4-14(15)18/h2-6,9H,7-8,10H2,1H3,(H,20,21)
InChIKeyKOOKUAHJLHTOEA-UHFFFAOYSA-N
MW351.24 g/mol
LogP3.91
Rot. Bonds4

About N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine

N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine (PubChem CID 56610280) has the molecular formula C16H16Cl2N4O and a molecular weight of 351.24 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine
PubChem CID56610280
Molecular FormulaC16H16Cl2N4O
Molecular Weight351.24 g/mol
Exact Mass350.07
IUPAC NameN-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine
SMILESCc1ccnc(CON2CCN=C2Nc2c(Cl)cccc2Cl)c1
InChIInChI=1S/C16H16Cl2N4O/c1-11-5-6-19-12(9-11)10-23-22-8-7-20-16(22)21-15-13(17)3-2-4-14(15)18/h2-6,9H,7-8,10H2,1H3,(H,20,21)
InChIKeyKOOKUAHJLHTOEA-UHFFFAOYSA-N
XLogP3.91
TPSA49.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.24
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine (CID 56610280) is N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine is Cc1ccnc(CON2CCN=C2Nc2c(Cl)cccc2Cl)c1.
What is the InChIKey of N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine?
The InChIKey is KOOKUAHJLHTOEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4O/c1-11-5-6-19-12(9-11)10-23-22-8-7-20-16(22)21-15-13(17)3-2-4-14(15)18/h2-6,9H,7-8,10H2,1H3,(H,20,21).
What are the key properties of N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine?
N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine has a molecular weight of 351.24 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-1-[(4-methyl-2-pyridinyl)methoxy]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 56610280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).