5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine

C10H17N — CID 45095831

IUPAC5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine
SMILESC=CC1=CCCN(C(C)C)C1
InChIInChI=1S/C10H17N/c1-4-10-6-5-7-11(8-10)9(2)3/h4,6,9H,1,5,7-8H2,2-3H3
InChIKeyQPQCLWMDLSAYDS-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.21
Rot. Bonds2

About 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine

5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine (PubChem CID 45095831) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine
PubChem CID45095831
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine
SMILESC=CC1=CCCN(C(C)C)C1
InChIInChI=1S/C10H17N/c1-4-10-6-5-7-11(8-10)9(2)3/h4,6,9H,1,5,7-8H2,2-3H3
InChIKeyQPQCLWMDLSAYDS-UHFFFAOYSA-N
XLogP2.21
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The IUPAC name of 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine (CID 45095831) is 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine is C=CC1=CCCN(C(C)C)C1.
What is the InChIKey of 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The InChIKey is QPQCLWMDLSAYDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-4-10-6-5-7-11(8-10)9(2)3/h4,6,9H,1,5,7-8H2,2-3H3.
What are the key properties of 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine?
5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine has a molecular weight of 151.25 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1-propan-2-yl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 45095831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).