3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane

C135H227N21 — CID 157417799

IUPAC3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane
SMILESC.C.C.CC(C)C1=CN(C(C)C)CN1.CC(C)c1cccc(C(C)C)n1.CC(C)c1cccnc1C(C)C.CC(C)c1ccnc(C(C)C)c1.CC(C)c1ccncc1C(C)C.CC(C)c1ccncc1C(C)C.CC(C)c1ccnnc1C(C)C.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cncc(C(C)C)c1.CC(C)c1cncnc1C(C)C.CC(C)c1cnncc1C(C)C.CC(C)c1nccnc1C(C)C
InChIInChI=1S/6C11H17N.4C10H16N2.C9H18N2.C9H16N2.C8H15N3.3CH4/c1-8(2)10-5-11(9(3)4)7-12-6-10;2*1-8(2)10-5-6-12-7-11(10)9(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;1-8(2)10-6-5-7-12-11(10)9(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;1-7(2)9-5-11-6-12-10(9)8(3)4;1-7(2)9-5-11-12-6-10(9)8(3)4;1-7(2)9-10(8(3)4)12-6-5-11-9;1-7(2)9-5-6-11-12-10(9)8(3)4;2*1-7(2)9-5-11(6-10-9)8(3)4;1-6(2)8-5-11(7(3)4)10-9-8;;;/h6*5-9H,1-4H3;4*5-8H,1-4H3;5,7-8,10H,6H2,1-4H3;5-8H,1-4H3;5-7H,1-4H3;3*1H4
InChIKeyBPBCCFKTQBEPSZ-UHFFFAOYSA-N
MW2144.45 g/mol
LogP39.10
Rot. Bonds26

About 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane

3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane (PubChem CID 157417799) has the molecular formula C135H227N21 and a molecular weight of 2144.45 g/mol. Its IUPAC name is 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane.

Molecular Properties

Compound Name3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane
PubChem CID157417799
Molecular FormulaC135H227N21
Molecular Weight2144.45 g/mol
Exact Mass2142.84
IUPAC Name3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane
SMILESC.C.C.CC(C)C1=CN(C(C)C)CN1.CC(C)c1cccc(C(C)C)n1.CC(C)c1cccnc1C(C)C.CC(C)c1ccnc(C(C)C)c1.CC(C)c1ccncc1C(C)C.CC(C)c1ccncc1C(C)C.CC(C)c1ccnnc1C(C)C.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cncc(C(C)C)c1.CC(C)c1cncnc1C(C)C.CC(C)c1cnncc1C(C)C.CC(C)c1nccnc1C(C)C
InChIInChI=1S/6C11H17N.4C10H16N2.C9H18N2.C9H16N2.C8H15N3.3CH4/c1-8(2)10-5-11(9(3)4)7-12-6-10;2*1-8(2)10-5-6-12-7-11(10)9(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;1-8(2)10-6-5-7-12-11(10)9(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;1-7(2)9-5-11-6-12-10(9)8(3)4;1-7(2)9-5-11-12-6-10(9)8(3)4;1-7(2)9-10(8(3)4)12-6-5-11-9;1-7(2)9-5-6-11-12-10(9)8(3)4;2*1-7(2)9-5-11(6-10-9)8(3)4;1-6(2)8-5-11(7(3)4)10-9-8;;;/h6*5-9H,1-4H3;4*5-8H,1-4H3;5,7-8,10H,6H2,1-4H3;5-8H,1-4H3;5-7H,1-4H3;3*1H4
InChIKeyBPBCCFKTQBEPSZ-UHFFFAOYSA-N
XLogP39.10
TPSA244.26 Ų
H-Bond Donors1
H-Bond Acceptors21
Rotatable Bonds26
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002144.45
LogP ≤ 539.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1021

Analyze 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane with MolForge

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Related Compounds

1,2-di(propan-2-yl)benzene;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;bis(2,3-di(propan-2-yl)pyridine);bis(3,4-di(propan-2-yl)pyridine);bis(4,5-di(propan-2-yl)pyrimidine)
CID 162214419
1,2-di(propan-2-yl)benzene;3,4-di(propan-2-yl)pyridazine;bis(2,3-di(propan-2-yl)pyridine);bis(3,4-di(propan-2-yl)pyridine);bis(4,5-di(propan-2-yl)pyrimidine)
CID 159280113
2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;ethane;methane
CID 159524432
1,2-di(propan-2-yl)benzene;2,3-di(propan-2-yl)pyridine;3,4-di(propan-2-yl)pyridine
CID 161335876
1,3-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;1,4-di(propan-2-yl)pyrazole;3,6-di(propan-2-yl)pyridazine;2,5-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)-2H-pyrrole;2,4-di(propan-2-yl)-1,3-thiazole
CID 162065002
2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;ethane
CID 159523313
ethane;3-methyl-2-propan-2-ylpyridine;bis(4-methyl-3-propan-2-ylpyridine)
CID 167681934
ethane;methane;3-methyl-2-propan-2-ylpyridine;3-methyl-4-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine
CID 159258113
2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;bis(4-propan-2-ylpyridazine);5-propan-2-ylpyrimidine
CID 159400797
1,2-di(propan-2-yl)benzene;1,6-di(propan-2-yl)-2H-pyridine;2,3-di(propan-2-yl)pyridine;3,4-di(propan-2-yl)pyridine
CID 157149020
1,3-di(propan-2-yl)piperazine;2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;methane
CID 157218723
ethane;4-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);tris(3-propan-2-ylpyridine);bis(4-propan-2-ylpyridine);4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine
CID 159364646

Frequently Asked Questions

What is the IUPAC name of 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane?
The IUPAC name of 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane (CID 157417799) is 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane.
What is the SMILES notation for 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane?
The canonical SMILES for 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane is C.C.C.CC(C)C1=CN(C(C)C)CN1.CC(C)c1cccc(C(C)C)n1.CC(C)c1cccnc1C(C)C.CC(C)c1ccnc(C(C)C)c1.CC(C)c1ccncc1C(C)C.CC(C)c1ccncc1C(C)C.CC(C)c1ccnnc1C(C)C.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cncc(C(C)C)c1.CC(C)c1cncnc1C(C)C.CC(C)c1cnncc1C(C)C.CC(C)c1nccnc1C(C)C.
What is the InChIKey of 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane?
The InChIKey is BPBCCFKTQBEPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/6C11H17N.4C10H16N2.C9H18N2.C9H16N2.C8H15N3.3CH4/c1-8(2)10-5-11(9(3)4)7-12-6-10;2*1-8(2)10-5-6-12-7-11(10)9(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;1-8(2)10-6-5-7-12-11(10)9(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;1-7(2)9-5-11-6-12-10(9)8(3)4;1-7(2)9-5-11-12-6-10(9)8(3)4;1-7(2)9-10(8(3)4)12-6-5-11-9;1-7(2)9-5-6-11-12-10(9)8(3)4;2*1-7(2)9-5-11(6-10-9)8(3)4;1-6(2)8-5-11(7(3)4)10-9-8;;;/h6*5-9H,1-4H3;4*5-8H,1-4H3;5,7-8,10H,6H2,1-4H3;5-8H,1-4H3;5-7H,1-4H3;3*1H4.
What are the key properties of 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane?
3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane has a molecular weight of 2144.45 g/mol, XLogP of 39.10, 26 rotatable bonds, 1 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-di(propan-2-yl)-1,2-dihydroimidazole;1,4-di(propan-2-yl)imidazole;2,3-di(propan-2-yl)pyrazine;3,4-di(propan-2-yl)pyridazine;4,5-di(propan-2-yl)pyridazine;2,3-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;bis(3,4-di(propan-2-yl)pyridine);3,5-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;1,4-di(propan-2-yl)triazole;methane is sourced from PubChem (CID 157417799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).