2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide

C15H27N3O3 — CID 62014316

IUPAC2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
SMILESCCC(CC)N(CCO)CC(=O)Nc1cc(C(C)C)no1
InChIInChI=1S/C15H27N3O3/c1-5-12(6-2)18(7-8-19)10-14(20)16-15-9-13(11(3)4)17-21-15/h9,11-12,19H,5-8,10H2,1-4H3,(H,16,20)
InChIKeyZXAALPOBKXNKFG-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.22
Rot. Bonds9

About 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide

2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide (PubChem CID 62014316) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
PubChem CID62014316
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC Name2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
SMILESCCC(CC)N(CCO)CC(=O)Nc1cc(C(C)C)no1
InChIInChI=1S/C15H27N3O3/c1-5-12(6-2)18(7-8-19)10-14(20)16-15-9-13(11(3)4)17-21-15/h9,11-12,19H,5-8,10H2,1-4H3,(H,16,20)
InChIKeyZXAALPOBKXNKFG-UHFFFAOYSA-N
XLogP2.22
TPSA78.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]-propan-2-ylamino]propanoic acid
CID 60840529
3-[ethyl-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]amino]propanoic acid
CID 61009524
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 78964549
2-[bis(furan-2-ylmethyl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 24626993
N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 89054004
2-[[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]-prop-2-ynylamino]acetic acid
CID 79284198
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 63304334
3-[2-hydroxyethyl(pentan-3-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 62015887
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide
CID 62016068
2-[ethyl(2-hydroxyethyl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 37097840
2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 60689757
2-[methyl(piperidin-4-ylmethyl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 79701828

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide (CID 62014316) is 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide is CCC(CC)N(CCO)CC(=O)Nc1cc(C(C)C)no1.
What is the InChIKey of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The InChIKey is ZXAALPOBKXNKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-5-12(6-2)18(7-8-19)10-14(20)16-15-9-13(11(3)4)17-21-15/h9,11-12,19H,5-8,10H2,1-4H3,(H,16,20).
What are the key properties of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide has a molecular weight of 297.40 g/mol, XLogP of 2.22, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 62014316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).