4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide

C16H18N4O3 — CID 109080854

IUPAC4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
SMILESCc1cc(NC(=O)c2cc(C(=O)NC3CCCC3)ccn2)no1
InChIInChI=1S/C16H18N4O3/c1-10-8-14(20-23-10)19-16(22)13-9-11(6-7-17-13)15(21)18-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3,(H,18,21)(H,19,20,22)
InChIKeyIQHGQCBCZYJTOD-UHFFFAOYSA-N
MW314.35 g/mol
LogP2.30
Rot. Bonds4

About 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide

4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide (PubChem CID 109080854) has the molecular formula C16H18N4O3 and a molecular weight of 314.35 g/mol. Its IUPAC name is 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
PubChem CID109080854
Molecular FormulaC16H18N4O3
Molecular Weight314.35 g/mol
Exact Mass314.14
IUPAC Name4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
SMILESCc1cc(NC(=O)c2cc(C(=O)NC3CCCC3)ccn2)no1
InChIInChI=1S/C16H18N4O3/c1-10-8-14(20-23-10)19-16(22)13-9-11(6-7-17-13)15(21)18-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3,(H,18,21)(H,19,20,22)
InChIKeyIQHGQCBCZYJTOD-UHFFFAOYSA-N
XLogP2.30
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide (CID 109080854) is 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide is Cc1cc(NC(=O)c2cc(C(=O)NC3CCCC3)ccn2)no1.
What is the InChIKey of 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide?
The InChIKey is IQHGQCBCZYJTOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c1-10-8-14(20-23-10)19-16(22)13-9-11(6-7-17-13)15(21)18-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3,(H,18,21)(H,19,20,22).
What are the key properties of 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide?
4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide has a molecular weight of 314.35 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109080854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).