N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine

C10H17N3O — CID 43607721

IUPACN-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine
SMILESCN(Cc1ccno1)C1CCNCC1
InChIInChI=1S/C10H17N3O/c1-13(8-10-4-7-12-14-10)9-2-5-11-6-3-9/h4,7,9,11H,2-3,5-6,8H2,1H3
InChIKeyKTZDKUAJCVXTIV-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.86
Rot. Bonds3

About N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine

N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine (PubChem CID 43607721) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine
PubChem CID43607721
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine
SMILESCN(Cc1ccno1)C1CCNCC1
InChIInChI=1S/C10H17N3O/c1-13(8-10-4-7-12-14-10)9-2-5-11-6-3-9/h4,7,9,11H,2-3,5-6,8H2,1H3
InChIKeyKTZDKUAJCVXTIV-UHFFFAOYSA-N
XLogP0.86
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine?
The IUPAC name of N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine (CID 43607721) is N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine is CN(Cc1ccno1)C1CCNCC1.
What is the InChIKey of N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine?
The InChIKey is KTZDKUAJCVXTIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13(8-10-4-7-12-14-10)9-2-5-11-6-3-9/h4,7,9,11H,2-3,5-6,8H2,1H3.
What are the key properties of N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine?
N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine has a molecular weight of 195.27 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1,2-oxazol-5-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 43607721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).