5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine

C18H24N6 — CID 56738597

IUPAC5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine
SMILESCc1cc(C)n(CCCn2ccnc2-c2ccc(N(C)C)nc2)n1
InChIInChI=1S/C18H24N6/c1-14-12-15(2)24(21-14)10-5-9-23-11-8-19-18(23)16-6-7-17(20-13-16)22(3)4/h6-8,11-13H,5,9-10H2,1-4H3
InChIKeyULQHFJKVAVDXBI-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.91
Rot. Bonds6

About 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine

5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine (PubChem CID 56738597) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine
PubChem CID56738597
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC Name5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine
SMILESCc1cc(C)n(CCCn2ccnc2-c2ccc(N(C)C)nc2)n1
InChIInChI=1S/C18H24N6/c1-14-12-15(2)24(21-14)10-5-9-23-11-8-19-18(23)16-6-7-17(20-13-16)22(3)4/h6-8,11-13H,5,9-10H2,1-4H3
InChIKeyULQHFJKVAVDXBI-UHFFFAOYSA-N
XLogP2.91
TPSA51.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine (CID 56738597) is 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine is Cc1cc(C)n(CCCn2ccnc2-c2ccc(N(C)C)nc2)n1.
What is the InChIKey of 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine?
The InChIKey is ULQHFJKVAVDXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6/c1-14-12-15(2)24(21-14)10-5-9-23-11-8-19-18(23)16-6-7-17(20-13-16)22(3)4/h6-8,11-13H,5,9-10H2,1-4H3.
What are the key properties of 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine?
5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine has a molecular weight of 324.43 g/mol, XLogP of 2.91, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[3-(3,5-dimethylpyrazol-1-yl)propyl]imidazol-2-yl]-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 56738597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).