3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine

C12H17N3 — CID 14089492

IUPAC3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine
SMILESCC(C)C1CN=C(c2cccnc2)N1C
InChIInChI=1S/C12H17N3/c1-9(2)11-8-14-12(15(11)3)10-5-4-6-13-7-10/h4-7,9,11H,8H2,1-3H3
InChIKeySAJBPHJCTLTGNY-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.80
Rot. Bonds2

About 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine

3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine (PubChem CID 14089492) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine.

Molecular Properties

Compound Name3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine
PubChem CID14089492
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine
SMILESCC(C)C1CN=C(c2cccnc2)N1C
InChIInChI=1S/C12H17N3/c1-9(2)11-8-14-12(15(11)3)10-5-4-6-13-7-10/h4-7,9,11H,8H2,1-3H3
InChIKeySAJBPHJCTLTGNY-UHFFFAOYSA-N
XLogP1.80
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine?
The IUPAC name of 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine (CID 14089492) is 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine.
What is the SMILES notation for 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine?
The canonical SMILES for 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine is CC(C)C1CN=C(c2cccnc2)N1C.
What is the InChIKey of 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine?
The InChIKey is SAJBPHJCTLTGNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-9(2)11-8-14-12(15(11)3)10-5-4-6-13-7-10/h4-7,9,11H,8H2,1-3H3.
What are the key properties of 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine?
3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine has a molecular weight of 203.29 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methyl-5-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine is sourced from PubChem (CID 14089492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).