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

C19H19N3O2 — CID 6539756

IUPACN-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide
SMILESCc1ccc(-c2cc3c(NC(=O)C4CCCC4)ncnc3o2)cc1
InChIInChI=1S/C19H19N3O2/c1-12-6-8-13(9-7-12)16-10-15-17(20-11-21-19(15)24-16)22-18(23)14-4-2-3-5-14/h6-11,14H,2-5H2,1H3,(H,20,21,22,23)
InChIKeyFLBUNNVMGVJOEF-UHFFFAOYSA-N
MW321.38 g/mol
LogP4.33
Rot. Bonds3

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

N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide (PubChem CID 6539756) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide
PubChem CID6539756
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide
SMILESCc1ccc(-c2cc3c(NC(=O)C4CCCC4)ncnc3o2)cc1
InChIInChI=1S/C19H19N3O2/c1-12-6-8-13(9-7-12)16-10-15-17(20-11-21-19(15)24-16)22-18(23)14-4-2-3-5-14/h6-11,14H,2-5H2,1H3,(H,20,21,22,23)
InChIKeyFLBUNNVMGVJOEF-UHFFFAOYSA-N
XLogP4.33
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 54.33
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]cyclopentanecarboxamide?
The IUPAC name of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide (CID 6539756) is N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide is Cc1ccc(-c2cc3c(NC(=O)C4CCCC4)ncnc3o2)cc1.
What is the InChIKey of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide?
The InChIKey is FLBUNNVMGVJOEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-12-6-8-13(9-7-12)16-10-15-17(20-11-21-19(15)24-16)22-18(23)14-4-2-3-5-14/h6-11,14H,2-5H2,1H3,(H,20,21,22,23).
What are the key properties of N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide?
N-[6-(4-methylphenyl)furo[2,3-d]pyrimidin-4-yl]cyclopentanecarboxamide has a molecular weight of 321.38 g/mol, XLogP of 4.33, 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]cyclopentanecarboxamide is sourced from PubChem (CID 6539756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).