methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole

C11H26N2 — CID 159534289

IUPACmethane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole
SMILESC.CC(C)C.CC(C)C1=NCCN1
InChIInChI=1S/C6H12N2.C4H10.CH4/c1-5(2)6-7-3-4-8-6;1-4(2)3;/h5H,3-4H2,1-2H3,(H,7,8);4H,1-3H3;1H4
InChIKeyMDJUXYIQZMHFBC-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.94
Rot. Bonds1

About methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole

methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole (PubChem CID 159534289) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Namemethane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole
PubChem CID159534289
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Namemethane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole
SMILESC.CC(C)C.CC(C)C1=NCCN1
InChIInChI=1S/C6H12N2.C4H10.CH4/c1-5(2)6-7-3-4-8-6;1-4(2)3;/h5H,3-4H2,1-2H3,(H,7,8);4H,1-3H3;1H4
InChIKeyMDJUXYIQZMHFBC-UHFFFAOYSA-N
XLogP2.94
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

potassium 1-(4,5-dihydro-1H-imidazol-2-yl)ethanolate
CID 156743316
2-[1-(4-propan-2-ylphenyl)ethyl]-4,5-dihydro-1H-imidazole;hydrochloride
CID 66855168
2-(dimethoxymethyl)-4,5-dihydro-1H-imidazole
CID 55286461
2-[1-(disulfanyl)propan-2-yl]-4,5-dihydro-1H-imidazole;hydrate
CID 175075116
3-(4,5-dihydro-1H-imidazol-2-yl)pent-4-en-2-ol
CID 68992665
2-[1-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazole
CID 84664038
1-methyl-2-propan-2-yl-4,5-dihydroimidazole;2-propan-2-yl-4,5-dihydro-1H-imidazole;2-propan-2-yl-4,5-dihydro-1,3-oxazole
CID 161153455
3-propan-2-yl-5,6-dihydro-2H-1,2,4-thiadiazine 1,1-dioxide
CID 22898630
4-[1-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2,3-dimethylphenol;hydrobromide
CID 66856119
3-(4,5-dihydro-1H-imidazol-2-yl)tridecan-2-ol
CID 67821023
2-methyl-4,5-dihydro-1H-imidazole
CID 10798
2-[1-(4-methoxy-2,3-dimethylphenyl)ethyl]-4,5-dihydro-1H-imidazole
CID 58951787

Frequently Asked Questions

What is the IUPAC name of methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole?
The IUPAC name of methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole (CID 159534289) is methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole?
The canonical SMILES for methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole is C.CC(C)C.CC(C)C1=NCCN1.
What is the InChIKey of methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole?
The InChIKey is MDJUXYIQZMHFBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2.C4H10.CH4/c1-5(2)6-7-3-4-8-6;1-4(2)3;/h5H,3-4H2,1-2H3,(H,7,8);4H,1-3H3;1H4.
What are the key properties of methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole?
methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole has a molecular weight of 186.34 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 159534289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).