(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine

C9H15N — CID 123334877

IUPAC(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine
SMILESC/C=C1/CCCN=C1CC
InChIInChI=1S/C9H15N/c1-3-8-6-5-7-10-9(8)4-2/h3H,4-7H2,1-2H3/b8-3-
InChIKeyYAKOGUJGTRFUHC-BAQGIRSFSA-N
MW137.23 g/mol
LogP2.58
Rot. Bonds1

About (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine

(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine (PubChem CID 123334877) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine
PubChem CID123334877
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine
SMILESC/C=C1/CCCN=C1CC
InChIInChI=1S/C9H15N/c1-3-8-6-5-7-10-9(8)4-2/h3H,4-7H2,1-2H3/b8-3-
InChIKeyYAKOGUJGTRFUHC-BAQGIRSFSA-N
XLogP2.58
TPSA12.36 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 ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine?
The IUPAC name of (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine (CID 123334877) is (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine.
What is the SMILES notation for (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine?
The canonical SMILES for (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine is C/C=C1/CCCN=C1CC.
What is the InChIKey of (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine?
The InChIKey is YAKOGUJGTRFUHC-BAQGIRSFSA-N. The full InChI is InChI=1S/C9H15N/c1-3-8-6-5-7-10-9(8)4-2/h3H,4-7H2,1-2H3/b8-3-.
What are the key properties of (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine?
(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine has a molecular weight of 137.23 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 123334877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).