4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide

C15H14N6O2 — CID 44520938

IUPAC4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide
SMILESCc1cccnc1CNC(=O)c1nc(N)nc(-c2ccco2)n1
InChIInChI=1S/C15H14N6O2/c1-9-4-2-6-17-10(9)8-18-14(22)13-19-12(20-15(16)21-13)11-5-3-7-23-11/h2-7H,8H2,1H3,(H,18,22)(H2,16,19,20,21)
InChIKeyAIOIYFXDTRSDOY-UHFFFAOYSA-N
MW310.32 g/mol
LogP1.35
Rot. Bonds4

About 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide

4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide (PubChem CID 44520938) has the molecular formula C15H14N6O2 and a molecular weight of 310.32 g/mol. Its IUPAC name is 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide.

Molecular Properties

Compound Name4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide
PubChem CID44520938
Molecular FormulaC15H14N6O2
Molecular Weight310.32 g/mol
Exact Mass310.12
IUPAC Name4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide
SMILESCc1cccnc1CNC(=O)c1nc(N)nc(-c2ccco2)n1
InChIInChI=1S/C15H14N6O2/c1-9-4-2-6-17-10(9)8-18-14(22)13-19-12(20-15(16)21-13)11-5-3-7-23-11/h2-7H,8H2,1H3,(H,18,22)(H2,16,19,20,21)
InChIKeyAIOIYFXDTRSDOY-UHFFFAOYSA-N
XLogP1.35
TPSA119.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.32
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide?
The IUPAC name of 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide (CID 44520938) is 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide.
What is the SMILES notation for 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide?
The canonical SMILES for 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide is Cc1cccnc1CNC(=O)c1nc(N)nc(-c2ccco2)n1.
What is the InChIKey of 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide?
The InChIKey is AIOIYFXDTRSDOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O2/c1-9-4-2-6-17-10(9)8-18-14(22)13-19-12(20-15(16)21-13)11-5-3-7-23-11/h2-7H,8H2,1H3,(H,18,22)(H2,16,19,20,21).
What are the key properties of 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide?
4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide has a molecular weight of 310.32 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2-carboxamide is sourced from PubChem (CID 44520938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).