N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide

C17H22N4O3S — CID 126776239

IUPACN-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESO=C(CCc1nnc(-c2ccsc2)o1)NCC1CN(C2CC2)CCO1
InChIInChI=1S/C17H22N4O3S/c22-15(18-9-14-10-21(6-7-23-14)13-1-2-13)3-4-16-19-20-17(24-16)12-5-8-25-11-12/h5,8,11,13-14H,1-4,6-7,9-10H2,(H,18,22)
InChIKeyARZXVKHEOWRRPL-UHFFFAOYSA-N
MW362.46 g/mol
LogP1.71
Rot. Bonds7

About N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide

N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 126776239) has the molecular formula C17H22N4O3S and a molecular weight of 362.46 g/mol. Its IUPAC name is N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID126776239
Molecular FormulaC17H22N4O3S
Molecular Weight362.46 g/mol
Exact Mass362.14
IUPAC NameN-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESO=C(CCc1nnc(-c2ccsc2)o1)NCC1CN(C2CC2)CCO1
InChIInChI=1S/C17H22N4O3S/c22-15(18-9-14-10-21(6-7-23-14)13-1-2-13)3-4-16-19-20-17(24-16)12-5-8-25-11-12/h5,8,11,13-14H,1-4,6-7,9-10H2,(H,18,22)
InChIKeyARZXVKHEOWRRPL-UHFFFAOYSA-N
XLogP1.71
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.46
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

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CID 94024348
N-(3-methyl-2-morpholin-4-ylbutyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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N-[(5-bromothiophen-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 32822433
2-cyclopropyl-2-[3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanoylamino]acetic acid
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CID 38009868
N-[(4-methylphenyl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 38039853
N-[2-oxo-2-(propylamino)ethyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 38020884
N-[[4-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 55708548
N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 38037944
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Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide (CID 126776239) is N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide is O=C(CCc1nnc(-c2ccsc2)o1)NCC1CN(C2CC2)CCO1.
What is the InChIKey of N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is ARZXVKHEOWRRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3S/c22-15(18-9-14-10-21(6-7-23-14)13-1-2-13)3-4-16-19-20-17(24-16)12-5-8-25-11-12/h5,8,11,13-14H,1-4,6-7,9-10H2,(H,18,22).
What are the key properties of N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 362.46 g/mol, XLogP of 1.71, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 126776239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).