N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide

C15H24N4O3S — CID 119533077

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide
SMILESCCCN(C(=O)CSCC(=O)Nc1cc(C)on1)C1CCNC1
InChIInChI=1S/C15H24N4O3S/c1-3-6-19(12-4-5-16-8-12)15(21)10-23-9-14(20)17-13-7-11(2)22-18-13/h7,12,16H,3-6,8-10H2,1-2H3,(H,17,18,20)
InChIKeyQILOYWYUZNEWFX-UHFFFAOYSA-N
MW340.45 g/mol
LogP1.26
Rot. Bonds8

About N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide (PubChem CID 119533077) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide
PubChem CID119533077
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide
SMILESCCCN(C(=O)CSCC(=O)Nc1cc(C)on1)C1CCNC1
InChIInChI=1S/C15H24N4O3S/c1-3-6-19(12-4-5-16-8-12)15(21)10-23-9-14(20)17-13-7-11(2)22-18-13/h7,12,16H,3-6,8-10H2,1-2H3,(H,17,18,20)
InChIKeyQILOYWYUZNEWFX-UHFFFAOYSA-N
XLogP1.26
TPSA87.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide with MolForge

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 63304380
2-[2-[cyclopropylmethyl(propyl)amino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51166172
2-[ethyl(piperidin-3-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 63637463
N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607199
N-(5-methyl-1,2-oxazol-3-yl)-2-[2-(2-methylpentan-2-ylamino)-2-oxoethyl]sulfanylacetamide
CID 49416422
3-[azepan-4-yl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 104979433
2-[2-[cyclopropyl-[(1R)-1-(furan-2-yl)ethyl]amino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 94642953
N-piperidin-4-yl-N-propyl-2-propylsulfanylacetamide;hydrochloride
CID 119824316
N-(3-methyl-1,2-oxazol-5-yl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921752
2-[2-[[4-(dimethylamino)phenyl]methyl-methylamino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 35615784
N'-propyl-N'-pyrrolidin-3-ylpropanediamide
CID 119533204
N-propyl-N-pyrrolidin-3-yl-3,5-bis(trifluoromethyl)benzamide
CID 119531195

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide (CID 119533077) is N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide is CCCN(C(=O)CSCC(=O)Nc1cc(C)on1)C1CCNC1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide?
The InChIKey is QILOYWYUZNEWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-3-6-19(12-4-5-16-8-12)15(21)10-23-9-14(20)17-13-7-11(2)22-18-13/h7,12,16H,3-6,8-10H2,1-2H3,(H,17,18,20).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide has a molecular weight of 340.45 g/mol, XLogP of 1.26, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[propyl(pyrrolidin-3-yl)amino]ethyl]sulfanylacetamide is sourced from PubChem (CID 119533077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).