3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide

C8H15N5O2 — CID 103436886

IUPAC3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide
SMILESCCCNC(=O)CCNc1nnc(N)o1
InChIInChI=1S/C8H15N5O2/c1-2-4-10-6(14)3-5-11-8-13-12-7(9)15-8/h2-5H2,1H3,(H2,9,12)(H,10,14)(H,11,13)
InChIKeyPMSLYLWJOMFPSI-UHFFFAOYSA-N
MW213.24 g/mol
LogP-0.02
Rot. Bonds6

About 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide

3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide (PubChem CID 103436886) has the molecular formula C8H15N5O2 and a molecular weight of 213.24 g/mol. Its IUPAC name is 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide
PubChem CID103436886
Molecular FormulaC8H15N5O2
Molecular Weight213.24 g/mol
Exact Mass213.12
IUPAC Name3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide
SMILESCCCNC(=O)CCNc1nnc(N)o1
InChIInChI=1S/C8H15N5O2/c1-2-4-10-6(14)3-5-11-8-13-12-7(9)15-8/h2-5H2,1H3,(H2,9,12)(H,10,14)(H,11,13)
InChIKeyPMSLYLWJOMFPSI-UHFFFAOYSA-N
XLogP-0.02
TPSA106.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-3-[[5-(propylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]propanamide
CID 106964337
2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-methylacetamide
CID 103436631
3-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]amino]-N-(2-methoxyethyl)propanamide
CID 106964385
3-[[2-amino-6-(propylamino)pyrimidin-4-yl]amino]-N-propylpropanamide
CID 80819032
2-[[3-oxo-3-(propylamino)propyl]amino]pyridine-3-carboxamide
CID 61064041
3-[(3-amino-5-methyl-2-pyridinyl)amino]-N-propylpropanamide
CID 66281292
3-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-propylpropanamide
CID 103360319
3-[(5-amino-2-methyl-1H-imidazol-4-yl)amino]-N-propylpropanamide
CID 114999049
N-propyl-2-[[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]acetamide
CID 106969227
3-[(6-amino-5-methylpyrimidin-4-yl)amino]-N-propylpropanamide
CID 80819686
N-propyl-3-[[6-(propylamino)-2-pyridinyl]amino]propanamide
CID 80819033
3-[[4-chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino]-N-propylpropanamide
CID 80819257

Frequently Asked Questions

What is the IUPAC name of 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide?
The IUPAC name of 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide (CID 103436886) is 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide.
What is the SMILES notation for 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide?
The canonical SMILES for 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide is CCCNC(=O)CCNc1nnc(N)o1.
What is the InChIKey of 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide?
The InChIKey is PMSLYLWJOMFPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O2/c1-2-4-10-6(14)3-5-11-8-13-12-7(9)15-8/h2-5H2,1H3,(H2,9,12)(H,10,14)(H,11,13).
What are the key properties of 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide?
3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide has a molecular weight of 213.24 g/mol, XLogP of -0.02, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-N-propylpropanamide is sourced from PubChem (CID 103436886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).