N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide

C18H24N4O3 — CID 70776358

IUPACN-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)NCC(c2ccccn2)N2CCOCC2)no1
InChIInChI=1S/C18H24N4O3/c1-13(2)17-11-15(21-25-17)18(23)20-12-16(14-5-3-4-6-19-14)22-7-9-24-10-8-22/h3-6,11,13,16H,7-10,12H2,1-2H3,(H,20,23)
InChIKeySTROVDLXNLEYGG-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.00
Rot. Bonds6

About N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide

N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 70776358) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
PubChem CID70776358
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)NCC(c2ccccn2)N2CCOCC2)no1
InChIInChI=1S/C18H24N4O3/c1-13(2)17-11-15(21-25-17)18(23)20-12-16(14-5-3-4-6-19-14)22-7-9-24-10-8-22/h3-6,11,13,16H,7-10,12H2,1-2H3,(H,20,23)
InChIKeySTROVDLXNLEYGG-UHFFFAOYSA-N
XLogP2.00
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide (CID 70776358) is N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide is CC(C)c1cc(C(=O)NCC(c2ccccn2)N2CCOCC2)no1.
What is the InChIKey of N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is STROVDLXNLEYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-13(2)17-11-15(21-25-17)18(23)20-12-16(14-5-3-4-6-19-14)22-7-9-24-10-8-22/h3-6,11,13,16H,7-10,12H2,1-2H3,(H,20,23).
What are the key properties of N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 70776358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).