6-methylidene-1-propan-2-yl-2,3-dihydropyridine

C9H15N — CID 59374186

IUPAC6-methylidene-1-propan-2-yl-2,3-dihydropyridine
SMILESC=C1C=CCCN1C(C)C
InChIInChI=1S/C9H15N/c1-8(2)10-7-5-4-6-9(10)3/h4,6,8H,3,5,7H2,1-2H3
InChIKeyHJWBZJLLZQRUMX-UHFFFAOYSA-N
MW137.23 g/mol
LogP2.17
Rot. Bonds1

About 6-methylidene-1-propan-2-yl-2,3-dihydropyridine

6-methylidene-1-propan-2-yl-2,3-dihydropyridine (PubChem CID 59374186) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 6-methylidene-1-propan-2-yl-2,3-dihydropyridine.

Molecular Properties

Compound Name6-methylidene-1-propan-2-yl-2,3-dihydropyridine
PubChem CID59374186
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name6-methylidene-1-propan-2-yl-2,3-dihydropyridine
SMILESC=C1C=CCCN1C(C)C
InChIInChI=1S/C9H15N/c1-8(2)10-7-5-4-6-9(10)3/h4,6,8H,3,5,7H2,1-2H3
InChIKeyHJWBZJLLZQRUMX-UHFFFAOYSA-N
XLogP2.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methylidene-1-propan-2-yl-2,3-dihydropyridine?
The IUPAC name of 6-methylidene-1-propan-2-yl-2,3-dihydropyridine (CID 59374186) is 6-methylidene-1-propan-2-yl-2,3-dihydropyridine.
What is the SMILES notation for 6-methylidene-1-propan-2-yl-2,3-dihydropyridine?
The canonical SMILES for 6-methylidene-1-propan-2-yl-2,3-dihydropyridine is C=C1C=CCCN1C(C)C.
What is the InChIKey of 6-methylidene-1-propan-2-yl-2,3-dihydropyridine?
The InChIKey is HJWBZJLLZQRUMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-8(2)10-7-5-4-6-9(10)3/h4,6,8H,3,5,7H2,1-2H3.
What are the key properties of 6-methylidene-1-propan-2-yl-2,3-dihydropyridine?
6-methylidene-1-propan-2-yl-2,3-dihydropyridine has a molecular weight of 137.23 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-1-propan-2-yl-2,3-dihydropyridine is sourced from PubChem (CID 59374186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).