2-pyrrolidin-2-yl-1,2-dihydropyridine

C9H14N2 — CID 173058087

IUPAC2-pyrrolidin-2-yl-1,2-dihydropyridine
SMILESC1=CNC(C2CCCN2)C=C1
InChIInChI=1S/C9H14N2/c1-2-6-10-8(4-1)9-5-3-7-11-9/h1-2,4,6,8-11H,3,5,7H2
InChIKeyHPKFNIXZJRXIDN-UHFFFAOYSA-N
MW150.22 g/mol
LogP0.78
Rot. Bonds1

About 2-pyrrolidin-2-yl-1,2-dihydropyridine

2-pyrrolidin-2-yl-1,2-dihydropyridine (PubChem CID 173058087) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-pyrrolidin-2-yl-1,2-dihydropyridine.

Molecular Properties

Compound Name2-pyrrolidin-2-yl-1,2-dihydropyridine
PubChem CID173058087
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name2-pyrrolidin-2-yl-1,2-dihydropyridine
SMILESC1=CNC(C2CCCN2)C=C1
InChIInChI=1S/C9H14N2/c1-2-6-10-8(4-1)9-5-3-7-11-9/h1-2,4,6,8-11H,3,5,7H2
InChIKeyHPKFNIXZJRXIDN-UHFFFAOYSA-N
XLogP0.78
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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trans-(1R,2R)-2-[(2R)-pyrrolidin-2-yl]cyclohexan-1-ol
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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-2-yl-1,2-dihydropyridine?
The IUPAC name of 2-pyrrolidin-2-yl-1,2-dihydropyridine (CID 173058087) is 2-pyrrolidin-2-yl-1,2-dihydropyridine.
What is the SMILES notation for 2-pyrrolidin-2-yl-1,2-dihydropyridine?
The canonical SMILES for 2-pyrrolidin-2-yl-1,2-dihydropyridine is C1=CNC(C2CCCN2)C=C1.
What is the InChIKey of 2-pyrrolidin-2-yl-1,2-dihydropyridine?
The InChIKey is HPKFNIXZJRXIDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-2-6-10-8(4-1)9-5-3-7-11-9/h1-2,4,6,8-11H,3,5,7H2.
What are the key properties of 2-pyrrolidin-2-yl-1,2-dihydropyridine?
2-pyrrolidin-2-yl-1,2-dihydropyridine has a molecular weight of 150.22 g/mol, XLogP of 0.78, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-2-yl-1,2-dihydropyridine is sourced from PubChem (CID 173058087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).