3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide

C10H17N3O2 — CID 106417077

IUPAC3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide
SMILESCCCC(N)CC(=O)NCc1ccno1
InChIInChI=1S/C10H17N3O2/c1-2-3-8(11)6-10(14)12-7-9-4-5-13-15-9/h4-5,8H,2-3,6-7,11H2,1H3,(H,12,14)
InChIKeyCFUCEOABKVMCLV-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.81
Rot. Bonds6

About 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide

3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide (PubChem CID 106417077) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide.

Molecular Properties

Compound Name3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide
PubChem CID106417077
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide
SMILESCCCC(N)CC(=O)NCc1ccno1
InChIInChI=1S/C10H17N3O2/c1-2-3-8(11)6-10(14)12-7-9-4-5-13-15-9/h4-5,8H,2-3,6-7,11H2,1H3,(H,12,14)
InChIKeyCFUCEOABKVMCLV-UHFFFAOYSA-N
XLogP0.81
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-4,4-dimethyl-N-(1,2-oxazol-5-ylmethyl)pentanamide
CID 106417021
3-(1,2-oxazol-5-ylmethylcarbamoylamino)hexanoic acid
CID 114186675
2-(1,2-oxazol-5-ylmethylcarbamoylamino)pentanoic acid
CID 106421246
2-(N'-hydroxycarbamimidoyl)-N-(1,2-oxazol-5-ylmethyl)pentanamide
CID 114186807
N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
(2S)-2-amino-4-methyl-N-(1,2-oxazol-5-ylmethyl)pentanamide
CID 106416982
(2S)-2-amino-4-methylsulfanyl-N-(1,2-oxazol-5-ylmethyl)butanamide
CID 106417251
3-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]hexanamide
CID 106371365
2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide
CID 104600446
1-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415574
3-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]hexanamide
CID 114180296
2-(1,2-oxazol-5-ylmethylamino)-N-propylacetamide
CID 103605856

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide?
The IUPAC name of 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide (CID 106417077) is 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide.
What is the SMILES notation for 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide?
The canonical SMILES for 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide is CCCC(N)CC(=O)NCc1ccno1.
What is the InChIKey of 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide?
The InChIKey is CFUCEOABKVMCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-2-3-8(11)6-10(14)12-7-9-4-5-13-15-9/h4-5,8H,2-3,6-7,11H2,1H3,(H,12,14).
What are the key properties of 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide?
3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide has a molecular weight of 211.26 g/mol, XLogP of 0.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1,2-oxazol-5-ylmethyl)hexanamide is sourced from PubChem (CID 106417077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).