N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine

C11H19N3O — CID 81178472

IUPACN-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
SMILESCCNC1CCN(Cc2ccon2)CC1
InChIInChI=1S/C11H19N3O/c1-2-12-10-3-6-14(7-4-10)9-11-5-8-15-13-11/h5,8,10,12H,2-4,6-7,9H2,1H3
InChIKeyWUGNHYZWWHEYDJ-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.25
Rot. Bonds4

About N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine

N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine (PubChem CID 81178472) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
PubChem CID81178472
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
SMILESCCNC1CCN(Cc2ccon2)CC1
InChIInChI=1S/C11H19N3O/c1-2-12-10-3-6-14(7-4-10)9-11-5-8-15-13-11/h5,8,10,12H,2-4,6-7,9H2,1H3
InChIKeyWUGNHYZWWHEYDJ-UHFFFAOYSA-N
XLogP1.25
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The IUPAC name of N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine (CID 81178472) is N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine is CCNC1CCN(Cc2ccon2)CC1.
What is the InChIKey of N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The InChIKey is WUGNHYZWWHEYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-12-10-3-6-14(7-4-10)9-11-5-8-15-13-11/h5,8,10,12H,2-4,6-7,9H2,1H3.
What are the key properties of N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 81178472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).