5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine

C10H15N — CID 89212432

IUPAC5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine
SMILESCC/C=C\C1=CCCN=C1C
InChIInChI=1S/C10H15N/c1-3-4-6-10-7-5-8-11-9(10)2/h4,6-7H,3,5,8H2,1-2H3/b6-4-
InChIKeyBZMFAOQWXKZNFD-XQRVVYSFSA-N
MW149.24 g/mol
LogP2.74
Rot. Bonds2

About 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine

5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine (PubChem CID 89212432) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine.

Molecular Properties

Compound Name5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine
PubChem CID89212432
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine
SMILESCC/C=C\C1=CCCN=C1C
InChIInChI=1S/C10H15N/c1-3-4-6-10-7-5-8-11-9(10)2/h4,6-7H,3,5,8H2,1-2H3/b6-4-
InChIKeyBZMFAOQWXKZNFD-XQRVVYSFSA-N
XLogP2.74
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine?
The IUPAC name of 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine (CID 89212432) is 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine.
What is the SMILES notation for 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine?
The canonical SMILES for 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine is CC/C=C\C1=CCCN=C1C.
What is the InChIKey of 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine?
The InChIKey is BZMFAOQWXKZNFD-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H15N/c1-3-4-6-10-7-5-8-11-9(10)2/h4,6-7H,3,5,8H2,1-2H3/b6-4-.
What are the key properties of 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine?
5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine has a molecular weight of 149.24 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-but-1-enyl]-6-methyl-2,3-dihydropyridine is sourced from PubChem (CID 89212432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).