N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide

C14H17N3O2 — CID 112555357

IUPACN-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide
SMILESCc1cc(N)cnc1NC(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C14H17N3O2/c1-7-5-11(15)6-16-13(7)17-14(18)12-8(2)9(3)19-10(12)4/h5-6H,15H2,1-4H3,(H,16,17,18)
InChIKeyFMYVBCFKNMHVEQ-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.74
Rot. Bonds2

About N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide

N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide (PubChem CID 112555357) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide
PubChem CID112555357
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide
SMILESCc1cc(N)cnc1NC(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C14H17N3O2/c1-7-5-11(15)6-16-13(7)17-14(18)12-8(2)9(3)19-10(12)4/h5-6H,15H2,1-4H3,(H,16,17,18)
InChIKeyFMYVBCFKNMHVEQ-UHFFFAOYSA-N
XLogP2.74
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide (CID 112555357) is N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide is Cc1cc(N)cnc1NC(=O)c1c(C)oc(C)c1C.
What is the InChIKey of N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide?
The InChIKey is FMYVBCFKNMHVEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-7-5-11(15)6-16-13(7)17-14(18)12-8(2)9(3)19-10(12)4/h5-6H,15H2,1-4H3,(H,16,17,18).
What are the key properties of N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide?
N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-3-methyl-2-pyridinyl)-2,4,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 112555357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).