ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen

C16H24N2 — CID 144594165

IUPACethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen
SMILESCC.Cc1ncc(-c2ccc(C)c3c2CCC3)[nH]1.[H][H]
InChIInChI=1S/C14H16N2.C2H6.H2/c1-9-6-7-13(12-5-3-4-11(9)12)14-8-15-10(2)16-14;1-2;/h6-8H,3-5H2,1-2H3,(H,15,16);1-2H3;1H
InChIKeyNYWKJULPRUVOIR-UHFFFAOYSA-N
MW244.38 g/mol
LogP4.45
Rot. Bonds1

About ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen

ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen (PubChem CID 144594165) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen.

Molecular Properties

Compound Nameethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen
PubChem CID144594165
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Nameethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen
SMILESCC.Cc1ncc(-c2ccc(C)c3c2CCC3)[nH]1.[H][H]
InChIInChI=1S/C14H16N2.C2H6.H2/c1-9-6-7-13(12-5-3-4-11(9)12)14-8-15-10(2)16-14;1-2;/h6-8H,3-5H2,1-2H3,(H,15,16);1-2H3;1H
InChIKeyNYWKJULPRUVOIR-UHFFFAOYSA-N
XLogP4.45
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen;propane
CID 144633691
5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-2-prop-1-en-2-yl-1H-imidazole
CID 144689959
ethane;7-methyl-4-(2-methyl-1H-imidazol-5-yl)-1,3-benzoxazole;molecular hydrogen;propane
CID 144594113
5-(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-1H-imidazole;molecular hydrogen;propane
CID 144633819
5-methyl-8-(2-methyl-1H-imidazol-5-yl)isoquinoline
CID 145019270
2,3-difluoro-4-(2-methyl-1H-imidazol-5-yl)aniline
CID 167066939
5-(3-bromo-4-methylphenyl)-2-methyl-1H-imidazole
CID 58170463
azane;2-methyl-5-(4-methylphenyl)-1H-imidazole
CID 175302356
ethane;7-methyl-2,3-dihydro-1H-indene-4-carbonitrile
CID 142588105
2-methyl-5-[4-(4-methylphenyl)phenyl]-1H-imidazole
CID 118357531
[2-(2-methyl-1H-imidazol-5-yl)phenyl]methanamine
CID 105442686
1-[3-amino-4-(2-methyl-1H-imidazol-5-yl)anilino]ethenol
CID 122472489

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen?
The IUPAC name of ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen (CID 144594165) is ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen.
What is the SMILES notation for ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen?
The canonical SMILES for ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen is CC.Cc1ncc(-c2ccc(C)c3c2CCC3)[nH]1.[H][H].
What is the InChIKey of ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen?
The InChIKey is NYWKJULPRUVOIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2.C2H6.H2/c1-9-6-7-13(12-5-3-4-11(9)12)14-8-15-10(2)16-14;1-2;/h6-8H,3-5H2,1-2H3,(H,15,16);1-2H3;1H.
What are the key properties of ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen?
ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen has a molecular weight of 244.38 g/mol, XLogP of 4.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-5-(7-methyl-2,3-dihydro-1H-inden-4-yl)-1H-imidazole;molecular hydrogen is sourced from PubChem (CID 144594165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).