5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide

C19H19N5O2 — CID 42453677

About 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide

5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide (PubChem CID 42453677) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

• Compound Name: 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide
• PubChem CID: 42453677
• Molecular Formula: C19H19N5O2
• Molecular Weight: 349.39 g/mol
• Exact Mass: 349.15
• IUPAC Name: 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide
• SMILES: Cc1nc(-c2ccncc2)ncc1[C@H](C)NC(=O)c1ncoc1C1CC1
• InChI: InChI=1S/C19H19N5O2/c1-11-15(9-21-18(23-11)14-5-7-20-8-6-14)12(2)24-19(25)16-17(13-3-4-13)26-10-22-16/h5-10,12-13H,3-4H2,1-2H3,(H,24,25)/t12-/m0/s1
• InChIKey: UNTZWCOYLVFZFQ-LBPRGKRZSA-N
• XLogP: 3.20
• TPSA: 93.80 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	349.39
LogP ≤ 5	3.20
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide?

The IUPAC name of 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide (CID 42453677) is 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide.

What is the SMILES notation for 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide?

The canonical SMILES for 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide is Cc1nc(-c2ccncc2)ncc1[C@H](C)NC(=O)c1ncoc1C1CC1.

What is the InChIKey of 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide?

The InChIKey is UNTZWCOYLVFZFQ-LBPRGKRZSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-11-15(9-21-18(23-11)14-5-7-20-8-6-14)12(2)24-19(25)16-17(13-3-4-13)26-10-22-16/h5-10,12-13H,3-4H2,1-2H3,(H,24,25)/t12-/m0/s1.

What are the key properties of 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide?

5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclopropyl-N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 42453677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).