N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide

C12H13N3O3 — CID 122301541

IUPACN-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide
SMILESCOc1ncc(NC(=O)c2cc(C)oc2C)cn1
InChIInChI=1S/C12H13N3O3/c1-7-4-10(8(2)18-7)11(16)15-9-5-13-12(17-3)14-6-9/h4-6H,1-3H3,(H,15,16)
InChIKeyKHUJADYNDIIZRA-UHFFFAOYSA-N
MW247.25 g/mol
LogP1.95
Rot. Bonds3

About N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide

N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide (PubChem CID 122301541) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide
PubChem CID122301541
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC NameN-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide
SMILESCOc1ncc(NC(=O)c2cc(C)oc2C)cn1
InChIInChI=1S/C12H13N3O3/c1-7-4-10(8(2)18-7)11(16)15-9-5-13-12(17-3)14-6-9/h4-6H,1-3H3,(H,15,16)
InChIKeyKHUJADYNDIIZRA-UHFFFAOYSA-N
XLogP1.95
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-ethoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide
CID 122301975
N-[2-(dimethylamino)pyrimidin-5-yl]-2,5-dimethylfuran-3-carboxamide
CID 122297954
2,5-dimethyl-N-(2-phenylpyrimidin-5-yl)furan-3-carboxamide
CID 134009194
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-2,5-dimethylfuran-3-carboxamide
CID 83093523
2,5-dimethyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide
CID 18106811
2-[5-[(2,5-dimethylfuran-3-carbonyl)amino]-2-pyridinyl]acetic acid
CID 107338349
2,5-dimethyl-N-pyridin-3-ylfuran-3-carboxamide
CID 1225414
N-methoxy-2,5-dimethylfuran-3-carboxamide
CID 60716938
2-bromo-N-(2-methoxypyrimidin-5-yl)benzamide
CID 122301734
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 121137429
2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide
CID 25344560
N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide
CID 43175539

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide (CID 122301541) is N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide is COc1ncc(NC(=O)c2cc(C)oc2C)cn1.
What is the InChIKey of N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide?
The InChIKey is KHUJADYNDIIZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3/c1-7-4-10(8(2)18-7)11(16)15-9-5-13-12(17-3)14-6-9/h4-6H,1-3H3,(H,15,16).
What are the key properties of N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide?
N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide has a molecular weight of 247.25 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 122301541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).