4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine

C10H12N2 — CID 56975599

IUPAC4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine
SMILESC1=NCC=C(C2=CCN=CC2)C1
InChIInChI=1S/C10H12N2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1,3,6,8H,2,4-5,7H2
InChIKeyAPAUNQGTHMSQCK-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.79
Rot. Bonds1

About 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine

4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine (PubChem CID 56975599) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine.

Molecular Properties

Compound Name4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine
PubChem CID56975599
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine
SMILESC1=NCC=C(C2=CCN=CC2)C1
InChIInChI=1S/C10H12N2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1,3,6,8H,2,4-5,7H2
InChIKeyAPAUNQGTHMSQCK-UHFFFAOYSA-N
XLogP1.79
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4,5,6-Tetrahydroquinoline
CID 54214651
4-(2,3-Dihydropyridin-4-yl)-2,3-dihydropyridine
CID 89219434
6-methylidene-4,7-dihydro-1H-isoquinoline
CID 57125600
3,7,8,8a-Tetrahydroquinoline
CID 57279747
4,8-Dihydroisoquinoline
CID 57298362
8-cyclohex-2-en-1-ylidene-3H-azocine
CID 57325378
5-(4-Methylcyclohexa-1,3-dien-1-yl)-3,4-dihydropyridine
CID 89327957
3,4,6,8a-Tetrahydro-1,7-naphthyridine
CID 90705893
3,8a-Dihydroquinoline
CID 90751796
1,5,6,7-Tetrahydroisoquinoline
CID 90877689
(1Z)-8-azatricyclo[10.4.0.02,7]hexadeca-1,3,5,8,11,13,15-heptaene
CID 91001318
1,4,5,6-Tetrahydroisoquinoline
CID 91099923

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine?
The IUPAC name of 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine (CID 56975599) is 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine.
What is the SMILES notation for 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine?
The canonical SMILES for 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine is C1=NCC=C(C2=CCN=CC2)C1.
What is the InChIKey of 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine?
The InChIKey is APAUNQGTHMSQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1,3,6,8H,2,4-5,7H2.
What are the key properties of 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine?
4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine has a molecular weight of 160.22 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dihydropyridin-4-yl)-2,5-dihydropyridine is sourced from PubChem (CID 56975599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).