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

C14H23N3O3 — CID 110684632

IUPAC2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C(C)C)c(C(=O)NCCN2CCOCC2)o1
InChIInChI=1S/C14H23N3O3/c1-10(2)12-13(20-11(3)16-12)14(18)15-4-5-17-6-8-19-9-7-17/h10H,4-9H2,1-3H3,(H,15,18)
InChIKeyIXIDHXYIDHLYPI-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.17
Rot. Bonds5

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

2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide (PubChem CID 110684632) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide
PubChem CID110684632
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C(C)C)c(C(=O)NCCN2CCOCC2)o1
InChIInChI=1S/C14H23N3O3/c1-10(2)12-13(20-11(3)16-12)14(18)15-4-5-17-6-8-19-9-7-17/h10H,4-9H2,1-3H3,(H,15,18)
InChIKeyIXIDHXYIDHLYPI-UHFFFAOYSA-N
XLogP1.17
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-oxazole-5-carboxamide
CID 110684800
1-methyl-N-(2-morpholin-4-ylethyl)-3-propan-2-ylpyrazole-5-carboxamide
CID 70761922
2-methyl-4-propan-2-yl-N-prop-2-enyl-1,3-oxazole-5-carboxamide
CID 110684617
4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazole-2-carboxamide
CID 110696091
2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
CID 110764588
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
3,5-dimethyl-N-(2-morpholin-4-ylethyl)-1H-pyrazole-4-carboxamide
CID 43582644
2-(1-amino-2-hydroxypropyl)-N-(2-morpholin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 3829164
2-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684763
2-(2-methyl-6-propan-2-ylanilino)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109301621
5-chloro-1,3-dimethyl-N-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide
CID 47141788
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)acetamide
CID 110766797

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide?
The IUPAC name of 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide (CID 110684632) is 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide?
The canonical SMILES for 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide is Cc1nc(C(C)C)c(C(=O)NCCN2CCOCC2)o1.
What is the InChIKey of 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide?
The InChIKey is IXIDHXYIDHLYPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-10(2)12-13(20-11(3)16-12)14(18)15-4-5-17-6-8-19-9-7-17/h10H,4-9H2,1-3H3,(H,15,18).
What are the key properties of 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide?
2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110684632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).