5-tert-butyl-2-methylidene-1H-pyridine

C10H15N — CID 59212597

IUPAC5-tert-butyl-2-methylidene-1H-pyridine
SMILESC=C1C=CC(C(C)(C)C)=CN1
InChIInChI=1S/C10H15N/c1-8-5-6-9(7-11-8)10(2,3)4/h5-7,11H,1H2,2-4H3
InChIKeySNRNEFRREACMJR-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.59
Rot. Bonds

About 5-tert-butyl-2-methylidene-1H-pyridine

5-tert-butyl-2-methylidene-1H-pyridine (PubChem CID 59212597) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 5-tert-butyl-2-methylidene-1H-pyridine.

Molecular Properties

Compound Name5-tert-butyl-2-methylidene-1H-pyridine
PubChem CID59212597
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name5-tert-butyl-2-methylidene-1H-pyridine
SMILESC=C1C=CC(C(C)(C)C)=CN1
InChIInChI=1S/C10H15N/c1-8-5-6-9(7-11-8)10(2,3)4/h5-7,11H,1H2,2-4H3
InChIKeySNRNEFRREACMJR-UHFFFAOYSA-N
XLogP2.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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5-tert-butyl-2-methylidene-3-(trifluoromethyl)-1H-pyridine
CID 89639552
4-Methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)-1,2-dihydropyridine
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Cyclopentadienyliden-1,2-dihydropyridin
CID 21766056
(2E)-2-butan-2-ylidene-5-fluoro-1H-pyridine
CID 153348284
2-(4-fluorocyclohexa-2,4-dien-1-ylidene)-1H-pyridine
CID 172878565
4-Propyl-1,2-dihydropyridine
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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-methylidene-1H-pyridine?
The IUPAC name of 5-tert-butyl-2-methylidene-1H-pyridine (CID 59212597) is 5-tert-butyl-2-methylidene-1H-pyridine.
What is the SMILES notation for 5-tert-butyl-2-methylidene-1H-pyridine?
The canonical SMILES for 5-tert-butyl-2-methylidene-1H-pyridine is C=C1C=CC(C(C)(C)C)=CN1.
What is the InChIKey of 5-tert-butyl-2-methylidene-1H-pyridine?
The InChIKey is SNRNEFRREACMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-8-5-6-9(7-11-8)10(2,3)4/h5-7,11H,1H2,2-4H3.
What are the key properties of 5-tert-butyl-2-methylidene-1H-pyridine?
5-tert-butyl-2-methylidene-1H-pyridine has a molecular weight of 149.24 g/mol, XLogP of 2.59, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-methylidene-1H-pyridine is sourced from PubChem (CID 59212597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).