2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide

C17H16N4O2 — CID 11404060

IUPAC2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1nc(C(=O)NCc2ccccn2)cc(-c2ccc(C)o2)n1
InChIInChI=1S/C17H16N4O2/c1-11-6-7-16(23-11)14-9-15(21-12(2)20-14)17(22)19-10-13-5-3-4-8-18-13/h3-9H,10H2,1-2H3,(H,19,22)
InChIKeyIUZJLAZMQMGQLI-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.68
Rot. Bonds4

About 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide

2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 11404060) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID11404060
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC Name2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1nc(C(=O)NCc2ccccn2)cc(-c2ccc(C)o2)n1
InChIInChI=1S/C17H16N4O2/c1-11-6-7-16(23-11)14-9-15(21-12(2)20-14)17(22)19-10-13-5-3-4-8-18-13/h3-9H,10H2,1-2H3,(H,19,22)
InChIKeyIUZJLAZMQMGQLI-UHFFFAOYSA-N
XLogP2.68
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (CID 11404060) is 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is Cc1nc(C(=O)NCc2ccccn2)cc(-c2ccc(C)o2)n1.
What is the InChIKey of 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is IUZJLAZMQMGQLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-11-6-7-16(23-11)14-9-15(21-12(2)20-14)17(22)19-10-13-5-3-4-8-18-13/h3-9H,10H2,1-2H3,(H,19,22).
What are the key properties of 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 11404060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).