3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine

C10H17N3O — CID 83847589

IUPAC3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine
SMILESNc1cc(CCC2CCNCC2)no1
InChIInChI=1S/C10H17N3O/c11-10-7-9(13-14-10)2-1-8-3-5-12-6-4-8/h7-8,12H,1-6,11H2
InChIKeyDHYCJDDHJLBFHV-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.19
Rot. Bonds3

About 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine

3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine (PubChem CID 83847589) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine
PubChem CID83847589
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine
SMILESNc1cc(CCC2CCNCC2)no1
InChIInChI=1S/C10H17N3O/c11-10-7-9(13-14-10)2-1-8-3-5-12-6-4-8/h7-8,12H,1-6,11H2
InChIKeyDHYCJDDHJLBFHV-UHFFFAOYSA-N
XLogP1.19
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-Cyclobutyl-1,2-oxazol-5-amine
CID 28905677
3-(Pentan-3-yl)-1,2-oxazol-5-amine
CID 13168213
3-Pentyl-1,2-oxazol-5-amine
CID 28980024
2-[(3R,4S)-3-[(5-tert-butyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-N-cyclohexylacetamide
CID 40777334
3-(Butan-2-yl)-1,2-oxazol-5-amine
CID 13168212
3-Cyclopentyl-1,2-oxazol-5-amine
CID 13377310
3-Cyclohexyl-1,2-oxazol-5-amine
CID 13377311
3-(3,3-Dimethylcyclobutyl)-1,2-oxazol-5-amine
CID 162485557
N-tert-butyl-2-[(3R,4S)-3-[(5-tert-butyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]acetamide
CID 25313431
2-[(3R,4S)-3-[(5-tert-butyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-piperidin-1-ylethanone
CID 26742891
2-[(3R,4S)-3-[(5-butyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-N,N-diethylacetamide
CID 26742967
2-[(3R,4S)-3-[(5-butyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1-piperidin-1-ylethanone
CID 26742995

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine (CID 83847589) is 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine is Nc1cc(CCC2CCNCC2)no1.
What is the InChIKey of 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine?
The InChIKey is DHYCJDDHJLBFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c11-10-7-9(13-14-10)2-1-8-3-5-12-6-4-8/h7-8,12H,1-6,11H2.
What are the key properties of 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine?
3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine has a molecular weight of 195.27 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperidin-4-ylethyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 83847589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).