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

C16H15N5O2 — CID 44520941

IUPAC2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCc3ccccn3)nc(N)n2)o1
InChIInChI=1S/C16H15N5O2/c1-10-5-6-14(23-10)12-8-13(21-16(17)20-12)15(22)19-9-11-4-2-3-7-18-11/h2-8H,9H2,1H3,(H,19,22)(H2,17,20,21)
InChIKeyLJKPWPQGCKKQKY-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.95
Rot. Bonds4

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

2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 44520941) has the molecular formula C16H15N5O2 and a molecular weight of 309.33 g/mol. Its IUPAC name is 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID44520941
Molecular FormulaC16H15N5O2
Molecular Weight309.33 g/mol
Exact Mass309.12
IUPAC Name2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCc3ccccn3)nc(N)n2)o1
InChIInChI=1S/C16H15N5O2/c1-10-5-6-14(23-10)12-8-13(21-16(17)20-12)15(22)19-9-11-4-2-3-7-18-11/h2-8H,9H2,1H3,(H,19,22)(H2,17,20,21)
InChIKeyLJKPWPQGCKKQKY-UHFFFAOYSA-N
XLogP1.95
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (CID 44520941) is 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is Cc1ccc(-c2cc(C(=O)NCc3ccccn3)nc(N)n2)o1.
What is the InChIKey of 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is LJKPWPQGCKKQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O2/c1-10-5-6-14(23-10)12-8-13(21-16(17)20-12)15(22)19-9-11-4-2-3-7-18-11/h2-8H,9H2,1H3,(H,19,22)(H2,17,20,21).
What are the key properties of 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 44520941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).