N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide

C15H21N3O2 — CID 67239715

IUPACN-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide
SMILESO=C(Nc1ccc(C2CCNC2)cc1)N1CCOCC1
InChIInChI=1S/C15H21N3O2/c19-15(18-7-9-20-10-8-18)17-14-3-1-12(2-4-14)13-5-6-16-11-13/h1-4,13,16H,5-11H2,(H,17,19)
InChIKeyOCCAXLZULXSHFT-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.63
Rot. Bonds2

About N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide

N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide (PubChem CID 67239715) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide
PubChem CID67239715
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide
SMILESO=C(Nc1ccc(C2CCNC2)cc1)N1CCOCC1
InChIInChI=1S/C15H21N3O2/c19-15(18-7-9-20-10-8-18)17-14-3-1-12(2-4-14)13-5-6-16-11-13/h1-4,13,16H,5-11H2,(H,17,19)
InChIKeyOCCAXLZULXSHFT-UHFFFAOYSA-N
XLogP1.63
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide (CID 67239715) is N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide is O=C(Nc1ccc(C2CCNC2)cc1)N1CCOCC1.
What is the InChIKey of N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide?
The InChIKey is OCCAXLZULXSHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c19-15(18-7-9-20-10-8-18)17-14-3-1-12(2-4-14)13-5-6-16-11-13/h1-4,13,16H,5-11H2,(H,17,19).
What are the key properties of N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide?
N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrrolidin-3-ylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 67239715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).