N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide

C14H13N5O2 — CID 11737650

IUPACN-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide
SMILESCCC(=O)Nc1cc(-n2cccn2)nc(-c2ccco2)n1
InChIInChI=1S/C14H13N5O2/c1-2-13(20)16-11-9-12(19-7-4-6-15-19)18-14(17-11)10-5-3-8-21-10/h3-9H,2H2,1H3,(H,16,17,18,20)
InChIKeyWADWVLAZRXMGSM-UHFFFAOYSA-N
MW283.29 g/mol
LogP2.27
Rot. Bonds4

About N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide

N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide (PubChem CID 11737650) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide
PubChem CID11737650
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC NameN-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide
SMILESCCC(=O)Nc1cc(-n2cccn2)nc(-c2ccco2)n1
InChIInChI=1S/C14H13N5O2/c1-2-13(20)16-11-9-12(19-7-4-6-15-19)18-14(17-11)10-5-3-8-21-10/h3-9H,2H2,1H3,(H,16,17,18,20)
InChIKeyWADWVLAZRXMGSM-UHFFFAOYSA-N
XLogP2.27
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide?
The IUPAC name of N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide (CID 11737650) is N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide.
What is the SMILES notation for N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide?
The canonical SMILES for N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide is CCC(=O)Nc1cc(-n2cccn2)nc(-c2ccco2)n1.
What is the InChIKey of N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide?
The InChIKey is WADWVLAZRXMGSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c1-2-13(20)16-11-9-12(19-7-4-6-15-19)18-14(17-11)10-5-3-8-21-10/h3-9H,2H2,1H3,(H,16,17,18,20).
What are the key properties of N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide?
N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide has a molecular weight of 283.29 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]propanamide is sourced from PubChem (CID 11737650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).