N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide

C14H22N4O2 — CID 67400418

IUPACN-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide
SMILESCCOc1nc(N2CCCC2N(C)C(C)=O)ccc1N
InChIInChI=1S/C14H22N4O2/c1-4-20-14-11(15)7-8-12(16-14)18-9-5-6-13(18)17(3)10(2)19/h7-8,13H,4-6,9,15H2,1-3H3
InChIKeySGZZDJYNPIBQGO-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.47
Rot. Bonds4

About N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide

N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide (PubChem CID 67400418) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide
PubChem CID67400418
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide
SMILESCCOc1nc(N2CCCC2N(C)C(C)=O)ccc1N
InChIInChI=1S/C14H22N4O2/c1-4-20-14-11(15)7-8-12(16-14)18-9-5-6-13(18)17(3)10(2)19/h7-8,13H,4-6,9,15H2,1-3H3
InChIKeySGZZDJYNPIBQGO-UHFFFAOYSA-N
XLogP1.47
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide?
The IUPAC name of N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide (CID 67400418) is N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide.
What is the SMILES notation for N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide?
The canonical SMILES for N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide is CCOc1nc(N2CCCC2N(C)C(C)=O)ccc1N.
What is the InChIKey of N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide?
The InChIKey is SGZZDJYNPIBQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-4-20-14-11(15)7-8-12(16-14)18-9-5-6-13(18)17(3)10(2)19/h7-8,13H,4-6,9,15H2,1-3H3.
What are the key properties of N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide?
N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide has a molecular weight of 278.36 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-amino-6-ethoxy-2-pyridinyl)pyrrolidin-2-yl]-N-methylacetamide is sourced from PubChem (CID 67400418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).