N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide

C13H23N3O2 — CID 104579635

IUPACN-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide
SMILESCc1cnc(C(C)NC(C)C(=O)NC(C)(C)C)o1
InChIInChI=1S/C13H23N3O2/c1-8-7-14-12(18-8)10(3)15-9(2)11(17)16-13(4,5)6/h7,9-10,15H,1-6H3,(H,16,17)
InChIKeyXMZLPOHBNGBTLX-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.94
Rot. Bonds4

About N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide

N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide (PubChem CID 104579635) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide
PubChem CID104579635
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC NameN-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide
SMILESCc1cnc(C(C)NC(C)C(=O)NC(C)(C)C)o1
InChIInChI=1S/C13H23N3O2/c1-8-7-14-12(18-8)10(3)15-9(2)11(17)16-13(4,5)6/h7,9-10,15H,1-6H3,(H,16,17)
InChIKeyXMZLPOHBNGBTLX-UHFFFAOYSA-N
XLogP1.94
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N'-hydroxy-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanimidamide
CID 106388648
2-chloro-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]propanamide
CID 106388094
tert-butyl N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]carbamate
CID 103947091
3-chloro-2,2-dimethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]propanamide
CID 106388098
2-cyano-2-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]propanamide
CID 103949036
3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide
CID 106388299
3-chloro-2-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]propanamide
CID 106388092
4-(2-aminoethyl)-5,5-dimethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]hexanamide
CID 106388297
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-sulfanylacetamide
CID 106390070
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide
CID 106389909
2-[(5-bromopyrimidin-2-yl)amino]-N-tert-butylpropanamide
CID 112690234
N-tert-butyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]propanamide
CID 81410714

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide?
The IUPAC name of N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide (CID 104579635) is N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide.
What is the SMILES notation for N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide?
The canonical SMILES for N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide is Cc1cnc(C(C)NC(C)C(=O)NC(C)(C)C)o1.
What is the InChIKey of N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide?
The InChIKey is XMZLPOHBNGBTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-8-7-14-12(18-8)10(3)15-9(2)11(17)16-13(4,5)6/h7,9-10,15H,1-6H3,(H,16,17).
What are the key properties of N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide?
N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide has a molecular weight of 253.35 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]propanamide is sourced from PubChem (CID 104579635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).