5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine

C15H26N2 — CID 143204905

IUPAC5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine
SMILESCCC(CCC1(C)CCCN1)C1=CCCN=C1
InChIInChI=1S/C15H26N2/c1-3-13(14-6-4-10-16-12-14)7-9-15(2)8-5-11-17-15/h6,12-13,17H,3-5,7-11H2,1-2H3
InChIKeyCPZQAOPPNVMEGN-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.34
Rot. Bonds5

About 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine

5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine (PubChem CID 143204905) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine.

Molecular Properties

Compound Name5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine
PubChem CID143204905
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine
SMILESCCC(CCC1(C)CCCN1)C1=CCCN=C1
InChIInChI=1S/C15H26N2/c1-3-13(14-6-4-10-16-12-14)7-9-15(2)8-5-11-17-15/h6,12-13,17H,3-5,7-11H2,1-2H3
InChIKeyCPZQAOPPNVMEGN-UHFFFAOYSA-N
XLogP3.34
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-5-fluoro-3-[(2R)-pyrrolidin-2-yl]-2,3-dihydropyridine
CID 88982622
2-Fluoro-6-methyl-4-(pyrrolidin-3-ylmethyl)-2,3-dihydropyridine
CID 135135096
2-Methyl-4-(pyrrolidin-3-ylmethyl)-5-(trifluoromethyl)-2,3-dihydropyridine
CID 135135304
4-methyl-6-[[(3R)-pyrrolidin-3-yl]methyl]-2,3-dihydropyridin-2-amine
CID 89037011
N-methyl-7-[4-(4-methylhexyl)-2H-pyrrol-2-yl]heptan-2-amine
CID 123270462
4-[[4,4-Bis(prop-2-enyl)pyrrolidin-2-yl]methyl]-5-chloro-3-ethenyl-2-methyl-2,3-dihydropyridine
CID 123866438
2,6-Dimethyl-4-(pyrrolidin-3-ylmethyl)-2,3-dihydropyridine
CID 135135116
5-Methyl-4-(pyrrolidin-3-ylmethyl)-2,3-dihydropyridine
CID 135135306
(E)-4-[(Z)-4-(5-ethylpyrrolidin-3-yl)but-1-enyl]dodec-2-en-1-imine
CID 143188374
Ethane;5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine
CID 143204904
Methanamine;5-[3-methyl-4-(2-methylpyrrolidin-2-yl)butan-2-yl]-2,3-dihydropyridine
CID 143204907
2-(Cyclohexen-1-yl)-2-(2-methylpropyl)pyrrolidine
CID 106653530

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine?
The IUPAC name of 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine (CID 143204905) is 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine.
What is the SMILES notation for 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine?
The canonical SMILES for 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine is CCC(CCC1(C)CCCN1)C1=CCCN=C1.
What is the InChIKey of 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine?
The InChIKey is CPZQAOPPNVMEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-3-13(14-6-4-10-16-12-14)7-9-15(2)8-5-11-17-15/h6,12-13,17H,3-5,7-11H2,1-2H3.
What are the key properties of 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine?
5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine has a molecular weight of 234.39 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2-methylpyrrolidin-2-yl)pentan-3-yl]-2,3-dihydropyridine is sourced from PubChem (CID 143204905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).