2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine

C15H18N4 — CID 42943695

IUPAC2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine
SMILESCc1cc(N2CCCC2c2cccnc2)nc(C)n1
InChIInChI=1S/C15H18N4/c1-11-9-15(18-12(2)17-11)19-8-4-6-14(19)13-5-3-7-16-10-13/h3,5,7,9-10,14H,4,6,8H2,1-2H3
InChIKeyLGCMIZXUZDIDAF-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.83
Rot. Bonds2

About 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine

2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine (PubChem CID 42943695) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine.

Molecular Properties

Compound Name2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine
PubChem CID42943695
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine
SMILESCc1cc(N2CCCC2c2cccnc2)nc(C)n1
InChIInChI=1S/C15H18N4/c1-11-9-15(18-12(2)17-11)19-8-4-6-14(19)13-5-3-7-16-10-13/h3,5,7,9-10,14H,4,6,8H2,1-2H3
InChIKeyLGCMIZXUZDIDAF-UHFFFAOYSA-N
XLogP2.83
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine?
The IUPAC name of 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine (CID 42943695) is 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine.
What is the SMILES notation for 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine?
The canonical SMILES for 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine is Cc1cc(N2CCCC2c2cccnc2)nc(C)n1.
What is the InChIKey of 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine?
The InChIKey is LGCMIZXUZDIDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-11-9-15(18-12(2)17-11)19-8-4-6-14(19)13-5-3-7-16-10-13/h3,5,7,9-10,14H,4,6,8H2,1-2H3.
What are the key properties of 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine?
2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine has a molecular weight of 254.34 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)pyrimidine is sourced from PubChem (CID 42943695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).