N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide

C17H19N3O2 — CID 119849176

IUPACN-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)Nc1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C17H19N3O2/c21-16(11-13-5-4-10-18-13)20-14-8-9-17(19-12-14)22-15-6-2-1-3-7-15/h1-3,6-9,12-13,18H,4-5,10-11H2,(H,20,21)
InChIKeyRDVRMICIBPYASS-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.95
Rot. Bonds5

About N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide

N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide (PubChem CID 119849176) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
PubChem CID119849176
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)Nc1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C17H19N3O2/c21-16(11-13-5-4-10-18-13)20-14-8-9-17(19-12-14)22-15-6-2-1-3-7-15/h1-3,6-9,12-13,18H,4-5,10-11H2,(H,20,21)
InChIKeyRDVRMICIBPYASS-UHFFFAOYSA-N
XLogP2.95
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-phenoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119673254
N-(6-phenoxy-3-pyridinyl)pyrrolidine-2-carboxamide
CID 119849166
N-[6-(4-fluorophenoxy)-3-pyridinyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119941203
N-(3-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 61363868
N-[6-(4-methylphenoxy)-3-pyridinyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119941281
N-[6-(diethylamino)-3-pyridinyl]-2-pyrrolidin-2-ylacetamide
CID 61365011
N-phenyl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119756453
N-(4-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670724
N-[6-(4-fluorophenoxy)-3-pyridinyl]pyrrolidine-2-carboxamide
CID 119849104
N-[3-(2-fluoroethoxy)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119809010
3-[4-[(2-pyrrolidin-2-ylacetyl)amino]phenoxy]benzamide;hydrochloride
CID 119779671
N-[3-(pyridin-3-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119846187

Frequently Asked Questions

What is the IUPAC name of N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide (CID 119849176) is N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide is O=C(CC1CCCN1)Nc1ccc(Oc2ccccc2)nc1.
What is the InChIKey of N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is RDVRMICIBPYASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c21-16(11-13-5-4-10-18-13)20-14-8-9-17(19-12-14)22-15-6-2-1-3-7-15/h1-3,6-9,12-13,18H,4-5,10-11H2,(H,20,21).
What are the key properties of N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide?
N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 297.36 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119849176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).