4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole

C19H28N6 — CID 92612183

IUPAC4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole
SMILESCCCn1nc(C)c(-c2cncn2C[C@H](C)n2nc(C)cc2C)c1C
InChIInChI=1S/C19H28N6/c1-7-8-24-17(6)19(16(5)22-24)18-10-20-12-23(18)11-15(4)25-14(3)9-13(2)21-25/h9-10,12,15H,7-8,11H2,1-6H3/t15-/m0/s1
InChIKeyUXOVBJCQZNNZRZ-HNNXBMFYSA-N
MW340.48 g/mol
LogP3.85
Rot. Bonds6

About 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole

4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole (PubChem CID 92612183) has the molecular formula C19H28N6 and a molecular weight of 340.48 g/mol. Its IUPAC name is 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole.

Molecular Properties

Compound Name4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole
PubChem CID92612183
Molecular FormulaC19H28N6
Molecular Weight340.48 g/mol
Exact Mass340.24
IUPAC Name4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole
SMILESCCCn1nc(C)c(-c2cncn2C[C@H](C)n2nc(C)cc2C)c1C
InChIInChI=1S/C19H28N6/c1-7-8-24-17(6)19(16(5)22-24)18-10-20-12-23(18)11-15(4)25-14(3)9-13(2)21-25/h9-10,12,15H,7-8,11H2,1-6H3/t15-/m0/s1
InChIKeyUXOVBJCQZNNZRZ-HNNXBMFYSA-N
XLogP3.85
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.48
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole with MolForge

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Related Compounds

4-[3-[(2R)-2-(2-chlorophenoxy)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole
CID 92612154
1-[1-[5-(1-ethyl-3,5-dimethylpyrazol-4-yl)imidazol-1-yl]propan-2-yl]piperidine
CID 46980226
1-[1-[5-(1-ethyl-3,5-dimethylpyrazol-4-yl)imidazol-1-yl]propan-2-yl]piperidine;hydrochloride
CID 171667670
4-[3-[2-(2,4-dimethylphenoxy)ethyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole
CID 46980596
4-[3-[(1S)-1-(4-fluorophenyl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole
CID 92612156
1-[(2R)-1-[5-(1-cyclohexylpyrazol-4-yl)imidazol-1-yl]propan-2-yl]-3,5-dimethylpyrazole
CID 92612169
3-(3,5-dimethylpyrazol-1-yl)butanamide
CID 130652830
3-[5-(3,5-dimethyl-1-propylpyrazol-4-yl)imidazol-1-yl]-N,N-dimethyl-3-phenylpropan-1-amine;hydrochloride
CID 171667769
(2R)-2-(3,5-dimethylpyrazol-1-yl)-N-[(3-ethylimidazol-4-yl)methyl]propanamide
CID 124849946
3-(3,5-dimethylpyrazol-1-yl)butanethioamide
CID 60915402
3,5-dimethyl-1-(2-methylpentan-3-yl)pyrazole
CID 91218954
3-(3,5-dimethylpyrazol-1-yl)pentanenitrile
CID 43367601

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole?
The IUPAC name of 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole (CID 92612183) is 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole.
What is the SMILES notation for 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole?
The canonical SMILES for 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole is CCCn1nc(C)c(-c2cncn2C[C@H](C)n2nc(C)cc2C)c1C.
What is the InChIKey of 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole?
The InChIKey is UXOVBJCQZNNZRZ-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H28N6/c1-7-8-24-17(6)19(16(5)22-24)18-10-20-12-23(18)11-15(4)25-14(3)9-13(2)21-25/h9-10,12,15H,7-8,11H2,1-6H3/t15-/m0/s1.
What are the key properties of 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole?
4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole has a molecular weight of 340.48 g/mol, XLogP of 3.85, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-4-yl]-3,5-dimethyl-1-propylpyrazole is sourced from PubChem (CID 92612183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).