N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride

C17H24ClN3O4 — CID 119713835

IUPACN-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C1COCCN1
InChIInChI=1S/C17H23N3O4.ClH/c21-16(20-7-1-2-8-20)12-24-14-5-3-4-13(10-14)19-17(22)15-11-23-9-6-18-15;/h3-5,10,15,18H,1-2,6-9,11-12H2,(H,19,22);1H
InChIKeyKORGFGPJAPGHMH-UHFFFAOYSA-N
MW369.85 g/mol
LogP1.04
Rot. Bonds5

About N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride

N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119713835) has the molecular formula C17H24ClN3O4 and a molecular weight of 369.85 g/mol. Its IUPAC name is N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119713835
Molecular FormulaC17H24ClN3O4
Molecular Weight369.85 g/mol
Exact Mass369.15
IUPAC NameN-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C1COCCN1
InChIInChI=1S/C17H23N3O4.ClH/c21-16(20-7-1-2-8-20)12-24-14-5-3-4-13(10-14)19-17(22)15-11-23-9-6-18-15;/h3-5,10,15,18H,1-2,6-9,11-12H2,(H,19,22);1H
InChIKeyKORGFGPJAPGHMH-UHFFFAOYSA-N
XLogP1.04
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.85
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-2-methyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide
CID 120922893
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-2-carboxamide
CID 119713878
N-(3-phenoxyphenyl)morpholine-3-carboxamide
CID 75422303
N-[3-(trifluoromethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119703130
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119284193
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-[3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119899006
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119713879
3-amino-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119713843
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-(3-pyridin-2-yloxyphenyl)morpholine-3-carboxamide
CID 119884828
N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]morpholine-3-carboxamide;hydrochloride
CID 119759666

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride (CID 119713835) is N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride is Cl.O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C1COCCN1.
What is the InChIKey of N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is KORGFGPJAPGHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4.ClH/c21-16(20-7-1-2-8-20)12-24-14-5-3-4-13(10-14)19-17(22)15-11-23-9-6-18-15;/h3-5,10,15,18H,1-2,6-9,11-12H2,(H,19,22);1H.
What are the key properties of N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride?
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 369.85 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119713835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).