N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide

C17H15N3O2 — CID 6539751

IUPACN-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide
SMILESCc1ccc(-c2cc3c(NC(=O)C4CC4)ncnc3o2)cc1
InChIInChI=1S/C17H15N3O2/c1-10-2-4-11(5-3-10)14-8-13-15(18-9-19-17(13)22-14)20-16(21)12-6-7-12/h2-5,8-9,12H,6-7H2,1H3,(H,18,19,20,21)
InChIKeyNITFTDTXTHHURN-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.55
Rot. Bonds3

About N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide

N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide (PubChem CID 6539751) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide
PubChem CID6539751
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide
SMILESCc1ccc(-c2cc3c(NC(=O)C4CC4)ncnc3o2)cc1
InChIInChI=1S/C17H15N3O2/c1-10-2-4-11(5-3-10)14-8-13-15(18-9-19-17(13)22-14)20-16(21)12-6-7-12/h2-5,8-9,12H,6-7H2,1H3,(H,18,19,20,21)
InChIKeyNITFTDTXTHHURN-UHFFFAOYSA-N
XLogP3.55
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide (CID 6539751) is N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide is Cc1ccc(-c2cc3c(NC(=O)C4CC4)ncnc3o2)cc1.
What is the InChIKey of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide?
The InChIKey is NITFTDTXTHHURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-10-2-4-11(5-3-10)14-8-13-15(18-9-19-17(13)22-14)20-16(21)12-6-7-12/h2-5,8-9,12H,6-7H2,1H3,(H,18,19,20,21).
What are the key properties of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide?
N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide has a molecular weight of 293.33 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopropanecarboxamide is sourced from PubChem (CID 6539751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).