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

C17H17N5O2 — CID 11324754

IUPAC2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCNc1nc(C(=O)NCc2ccccn2)cc(-c2ccc(C)o2)n1
InChIInChI=1S/C17H17N5O2/c1-11-6-7-15(24-11)13-9-14(22-17(18-2)21-13)16(23)20-10-12-5-3-4-8-19-12/h3-9H,10H2,1-2H3,(H,20,23)(H,18,21,22)
InChIKeyHBWXRCCGCWQONM-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.41
Rot. Bonds5

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

2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 11324754) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID11324754
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCNc1nc(C(=O)NCc2ccccn2)cc(-c2ccc(C)o2)n1
InChIInChI=1S/C17H17N5O2/c1-11-6-7-15(24-11)13-9-14(22-17(18-2)21-13)16(23)20-10-12-5-3-4-8-19-12/h3-9H,10H2,1-2H3,(H,20,23)(H,18,21,22)
InChIKeyHBWXRCCGCWQONM-UHFFFAOYSA-N
XLogP2.41
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (CID 11324754) is 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is CNc1nc(C(=O)NCc2ccccn2)cc(-c2ccc(C)o2)n1.
What is the InChIKey of 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is HBWXRCCGCWQONM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-11-6-7-15(24-11)13-9-14(22-17(18-2)21-13)16(23)20-10-12-5-3-4-8-19-12/h3-9H,10H2,1-2H3,(H,20,23)(H,18,21,22).
What are the key properties of 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 11324754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).