6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine

C10H17N — CID 145003994

IUPAC6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine
SMILESCC1=CC(CC(C)C)=CCN1
InChIInChI=1S/C10H17N/c1-8(2)6-10-4-5-11-9(3)7-10/h4,7-8,11H,5-6H2,1-3H3
InChIKeyVWEHNQCZRVWFMP-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.47
Rot. Bonds2

About 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine

6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine (PubChem CID 145003994) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine.

Molecular Properties

Compound Name6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine
PubChem CID145003994
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine
SMILESCC1=CC(CC(C)C)=CCN1
InChIInChI=1S/C10H17N/c1-8(2)6-10-4-5-11-9(3)7-10/h4,7-8,11H,5-6H2,1-3H3
InChIKeyVWEHNQCZRVWFMP-UHFFFAOYSA-N
XLogP2.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine?
The IUPAC name of 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine (CID 145003994) is 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine.
What is the SMILES notation for 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine?
The canonical SMILES for 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine is CC1=CC(CC(C)C)=CCN1.
What is the InChIKey of 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine?
The InChIKey is VWEHNQCZRVWFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-8(2)6-10-4-5-11-9(3)7-10/h4,7-8,11H,5-6H2,1-3H3.
What are the key properties of 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine?
6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine has a molecular weight of 151.25 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(2-methylpropyl)-1,2-dihydropyridine is sourced from PubChem (CID 145003994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).