5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole

C53H93N27S2 — CID 162182264

IUPAC5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole
SMILESCC(C)C1=NC=NC1.CC(C)c1ccn[nH]1.CC(C)c1cn[nH]c1.CC(C)c1cn[nH]n1.CC(C)c1cnc(N)s1.CC(C)c1csc(N)n1.CC(C)c1ncn[nH]1.CC(C)c1nn[nH]n1.CC(C)n1cncn1.CC(C)n1cnnn1
InChIInChI=1S/2C6H10N2S.3C6H10N2.3C5H9N3.2C4H8N4/c1-4(2)5-3-9-6(7)8-5;1-4(2)5-3-8-6(7)9-5;1-5(2)6-3-7-4-8-6;1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-7-8-6;1-5(2)8-4-6-3-7-8;1-4(2)5-6-3-7-8-5;1-4(2)5-3-6-8-7-5;1-4(2)8-3-5-6-7-8;1-3(2)4-5-7-8-6-4/h2*3-4H,1-2H3,(H2,7,8);4-5H,3H2,1-2H3;2*3-5H,1-2H3,(H,7,8);3-5H,1-2H3;2*3-4H,1-2H3,(H,6,7,8);3-4H,1-2H3;3H,1-2H3,(H,5,6,7,8)
InChIKeyZPENKJCJJJNLFF-UHFFFAOYSA-N
MW1172.65 g/mol
LogP11.18
Rot. Bonds10

About 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole

5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole (PubChem CID 162182264) has the molecular formula C53H93N27S2 and a molecular weight of 1172.65 g/mol. Its IUPAC name is 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole.

Molecular Properties

Compound Name5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole
PubChem CID162182264
Molecular FormulaC53H93N27S2
Molecular Weight1172.65 g/mol
Exact Mass1171.75
IUPAC Name5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole
SMILESCC(C)C1=NC=NC1.CC(C)c1ccn[nH]1.CC(C)c1cn[nH]c1.CC(C)c1cn[nH]n1.CC(C)c1cnc(N)s1.CC(C)c1csc(N)n1.CC(C)c1ncn[nH]1.CC(C)c1nn[nH]n1.CC(C)n1cncn1.CC(C)n1cnnn1
InChIInChI=1S/2C6H10N2S.3C6H10N2.3C5H9N3.2C4H8N4/c1-4(2)5-3-9-6(7)8-5;1-4(2)5-3-8-6(7)9-5;1-5(2)6-3-7-4-8-6;1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-7-8-6;1-5(2)8-4-6-3-7-8;1-4(2)5-6-3-7-8-5;1-4(2)5-3-6-8-7-5;1-4(2)8-3-5-6-7-8;1-3(2)4-5-7-8-6-4/h2*3-4H,1-2H3,(H2,7,8);4-5H,3H2,1-2H3;2*3-5H,1-2H3,(H,7,8);3-5H,1-2H3;2*3-4H,1-2H3,(H,6,7,8);3-4H,1-2H3;3H,1-2H3,(H,5,6,7,8)
InChIKeyZPENKJCJJJNLFF-UHFFFAOYSA-N
XLogP11.18
TPSA371.81 Ų
H-Bond Donors7
H-Bond Acceptors24
Rotatable Bonds10
Heavy Atoms82
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001172.65
LogP ≤ 511.18
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1024

Analyze 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole with MolForge

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Launch Full Analysis

Related Compounds

2-[2-[4-[2-(1H-imidazol-2-yl)ethyl]-5-(1H-imidazol-2-ylmethyl)-3-(1H-pyrazol-5-ylmethyl)pyrazol-1-yl]ethyl]-1,3-thiazole
CID 141056230
4-[5-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-1-(1H-pyrrol-2-yl)-3-(1,2-thiazol-3-yl)-4-(1,3-thiazol-2-yl)triazolidin-2-yl]thiadiazole
CID 141328720
2-methyl-1H-imidazole;5-methyl-1H-imidazole;1-methylpyrazole;5-methyl-1H-pyrazole;1-methyltetrazole;2-methyltetrazole;5-methyl-2H-tetrazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;1-methyl-1,2,4-triazole;2-methyltriazole;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole
CID 157074534
5-tert-butyl-2-ethenyl-1-methylimidazole;5-tert-butyl-3-ethenyl-1H-pyrazole;bis(4-tert-butyl-5-ethenyl-2H-pyrrole);bis(5-tert-butyl-2-ethenyl-3H-pyrrole);4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-3-methyl-1,2-thiazole
CID 157145620
2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;bis(4-propan-2-yl-2H-triazole);5-propan-2-yl-1H-1,2,4-triazole
CID 157146902
CID 157711565
CID 157711565
2-methylpropane;5-propan-2-yl-1H-imidazole;1-propan-2-ylpyrazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;pyridine
CID 157812436
CID 157887218
CID 157887218
2-methyl-1H-imidazole;5-methyl-1H-imidazole;1-methylpyrazole;5-methyl-1H-pyrazole;1-methyltetrazole;2-methyltetrazole;5-methyl-2H-tetrazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1,2-thiazole;5-methyl-1,3-thiazole;1-methyl-1,2,4-triazole;2-methyltriazole;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole
CID 157936459
5-tert-butyl-1,2-dimethylimidazole;4-tert-butyl-1,5-dimethylpyrazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-1H-pyrazole;5-tert-butyl-1,3-thiazole;4-tert-butyl-1,3,5-trimethylpyrazole;3,3-dimethylbut-1-ene;2,2,3-trimethylbutane
CID 158317854
methane;bis(2-propan-2-yl-1H-imidazole);5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1H-1,2,4-triazole
CID 158395781
5-tert-butyl-2-ethenyl-1-methylimidazole;5-tert-butyl-3-ethenyl-1H-pyrazole;3-tert-butyl-5-ethenyl-2H-pyrrole;bis(4-tert-butyl-5-ethenyl-2H-pyrrole);bis(5-tert-butyl-2-ethenyl-3H-pyrrole);4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-3-methyl-1,2-thiazole
CID 158413698

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole?
The IUPAC name of 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole (CID 162182264) is 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole.
What is the SMILES notation for 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole?
The canonical SMILES for 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole is CC(C)C1=NC=NC1.CC(C)c1ccn[nH]1.CC(C)c1cn[nH]c1.CC(C)c1cn[nH]n1.CC(C)c1cnc(N)s1.CC(C)c1csc(N)n1.CC(C)c1ncn[nH]1.CC(C)c1nn[nH]n1.CC(C)n1cncn1.CC(C)n1cnnn1.
What is the InChIKey of 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole?
The InChIKey is ZPENKJCJJJNLFF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H10N2S.3C6H10N2.3C5H9N3.2C4H8N4/c1-4(2)5-3-9-6(7)8-5;1-4(2)5-3-8-6(7)9-5;1-5(2)6-3-7-4-8-6;1-5(2)6-3-7-8-4-6;1-5(2)6-3-4-7-8-6;1-5(2)8-4-6-3-7-8;1-4(2)5-6-3-7-8-5;1-4(2)5-3-6-8-7-5;1-4(2)8-3-5-6-7-8;1-3(2)4-5-7-8-6-4/h2*3-4H,1-2H3,(H2,7,8);4-5H,3H2,1-2H3;2*3-5H,1-2H3,(H,7,8);3-5H,1-2H3;2*3-4H,1-2H3,(H,6,7,8);3-4H,1-2H3;3H,1-2H3,(H,5,6,7,8).
What are the key properties of 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole?
5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole has a molecular weight of 1172.65 g/mol, XLogP of 11.18, 10 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-4H-imidazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;4-propan-2-yl-1,3-thiazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;5-propan-2-yl-1H-1,2,4-triazole is sourced from PubChem (CID 162182264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).