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

C14H17N3O3S — CID 3244873

IUPACN-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc(-c2cccs2)on1
InChIInChI=1S/C14H17N3O3S/c18-14(15-3-4-17-5-7-19-8-6-17)11-10-12(20-16-11)13-2-1-9-21-13/h1-2,9-10H,3-8H2,(H,15,18)
InChIKeyQUNMJZUCPNYBMV-UHFFFAOYSA-N
MW307.38 g/mol
LogP1.47
Rot. Bonds5

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

N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 3244873) has the molecular formula C14H17N3O3S and a molecular weight of 307.38 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
PubChem CID3244873
Molecular FormulaC14H17N3O3S
Molecular Weight307.38 g/mol
Exact Mass307.10
IUPAC NameN-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc(-c2cccs2)on1
InChIInChI=1S/C14H17N3O3S/c18-14(15-3-4-17-5-7-19-8-6-17)11-10-12(20-16-11)13-2-1-9-21-13/h1-2,9-10H,3-8H2,(H,15,18)
InChIKeyQUNMJZUCPNYBMV-UHFFFAOYSA-N
XLogP1.47
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopropyl-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
CID 19582717
N-Cyclohexyl-5-(thiophen-2-yl)isoxazole-3-carboxamide
CID 15998429
4-{[5-(Thiophen-2-yl)-1,2-oxazol-3-yl]carbonyl}morpholine
CID 3242386
5-(4-methylphenyl)-N-(2-thienylmethyl)-3-isoxazolecarboxamide
CID 1093788
1-Piperidinyl-(5-thiophen-2-yl-3-isoxazolyl)methanone
CID 2745204
N-(propan-2-yl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
CID 2745205
5-thien-2-yl-N-(thien-2-ylmethyl)isoxazole-3-carboxamide
CID 3238191
N-(2-furylmethyl)-5-thien-2-ylisoxazole-3-carboxamide
CID 3238382
N-cyclopentyl-5-thien-2-ylisoxazole-3-carboxamide
CID 3242425
N-benzyl-5-thien-2-ylisoxazole-3-carboxamide
CID 3244595
N-(2-methoxyethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 4777443
5-cyclopropyl-N-(2-thenyl)isoxazole-3-carboxamide
CID 9550687

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide (CID 3244873) is N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide is O=C(NCCN1CCOCC1)c1cc(-c2cccs2)on1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is QUNMJZUCPNYBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S/c18-14(15-3-4-17-5-7-19-8-6-17)11-10-12(20-16-11)13-2-1-9-21-13/h1-2,9-10H,3-8H2,(H,15,18).
What are the key properties of N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 307.38 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3244873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).