N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide

C11H15N3O3 — CID 170731146

IUPACN-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(N)c(OCC2COC2)cn1
InChIInChI=1S/C11H15N3O3/c1-7(15)14-11-2-9(12)10(3-13-11)17-6-8-4-16-5-8/h2-3,8H,4-6H2,1H3,(H3,12,13,14,15)
InChIKeyIXDZKXNHKWEDLR-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.65
Rot. Bonds4

About N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide

N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide (PubChem CID 170731146) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide
PubChem CID170731146
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC NameN-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(N)c(OCC2COC2)cn1
InChIInChI=1S/C11H15N3O3/c1-7(15)14-11-2-9(12)10(3-13-11)17-6-8-4-16-5-8/h2-3,8H,4-6H2,1H3,(H3,12,13,14,15)
InChIKeyIXDZKXNHKWEDLR-UHFFFAOYSA-N
XLogP0.65
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide?
The IUPAC name of N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide (CID 170731146) is N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide is CC(=O)Nc1cc(N)c(OCC2COC2)cn1.
What is the InChIKey of N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide?
The InChIKey is IXDZKXNHKWEDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-7(15)14-11-2-9(12)10(3-13-11)17-6-8-4-16-5-8/h2-3,8H,4-6H2,1H3,(H3,12,13,14,15).
What are the key properties of N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide?
N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide has a molecular weight of 237.26 g/mol, XLogP of 0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-amino-5-(oxetan-3-ylmethoxy)-2-pyridinyl]acetamide is sourced from PubChem (CID 170731146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).