N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide

C17H24N2O3 — CID 119713721

IUPACN-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)Nc1cccc(OCC2CCCO2)c1
InChIInChI=1S/C17H24N2O3/c20-17(11-13-5-2-8-18-13)19-14-4-1-6-15(10-14)22-12-16-7-3-9-21-16/h1,4,6,10,13,16,18H,2-3,5,7-9,11-12H2,(H,19,20)
InChIKeyRQCJRQODVMCOSL-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.33
Rot. Bonds6

About N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide

N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 119713721) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
PubChem CID119713721
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)Nc1cccc(OCC2CCCO2)c1
InChIInChI=1S/C17H24N2O3/c20-17(11-13-5-2-8-18-13)19-14-4-1-6-15(10-14)22-12-16-7-3-9-21-16/h1,4,6,10,13,16,18H,2-3,5,7-9,11-12H2,(H,19,20)
InChIKeyRQCJRQODVMCOSL-UHFFFAOYSA-N
XLogP2.33
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(oxolan-2-ylmethoxy)phenyl]-2-thiomorpholin-3-ylacetamide
CID 119936406
2-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 119284095
N-(3-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 61363868
2-(ethylamino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54820938
N-[3-(2-fluoroethoxy)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119809010
4-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]butanamide
CID 119284123
2-(methylamino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide;hydrochloride
CID 119713691
2-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-N-[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
CID 98600366
2-(4-bromoanilino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54810968
N-(3-phenoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119673254
3-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]butanamide
CID 119713717
1-cyclopropyl-3-[3-(oxolan-2-ylmethoxy)phenyl]urea
CID 47162446

Frequently Asked Questions

What is the IUPAC name of N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide (CID 119713721) is N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide is O=C(CC1CCCN1)Nc1cccc(OCC2CCCO2)c1.
What is the InChIKey of N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is RQCJRQODVMCOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-17(11-13-5-2-8-18-13)19-14-4-1-6-15(10-14)22-12-16-7-3-9-21-16/h1,4,6,10,13,16,18H,2-3,5,7-9,11-12H2,(H,19,20).
What are the key properties of N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 304.39 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(oxolan-2-ylmethoxy)phenyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119713721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).