N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride

C13H18ClN3O4 — CID 119709306

IUPACN-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.NC(=O)COc1ccc(NC(=O)C2CNCCO2)cc1
InChIInChI=1S/C13H17N3O4.ClH/c14-12(17)8-20-10-3-1-9(2-4-10)16-13(18)11-7-15-5-6-19-11;/h1-4,11,15H,5-8H2,(H2,14,17)(H,16,18);1H
InChIKeyRFGMLPAUSJSBNI-UHFFFAOYSA-N
MW315.76 g/mol
LogP-0.10
Rot. Bonds5

About N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride

N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119709306) has the molecular formula C13H18ClN3O4 and a molecular weight of 315.76 g/mol. Its IUPAC name is N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119709306
Molecular FormulaC13H18ClN3O4
Molecular Weight315.76 g/mol
Exact Mass315.10
IUPAC NameN-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.NC(=O)COc1ccc(NC(=O)C2CNCCO2)cc1
InChIInChI=1S/C13H17N3O4.ClH/c14-12(17)8-20-10-3-1-9(2-4-10)16-13(18)11-7-15-5-6-19-11;/h1-4,11,15H,5-8H2,(H2,14,17)(H,16,18);1H
InChIKeyRFGMLPAUSJSBNI-UHFFFAOYSA-N
XLogP-0.10
TPSA102.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 5-0.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2,2,2-trifluoroethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119698644
N-[4-(oxolan-2-ylmethoxy)phenyl]morpholine-2-carboxamide
CID 119712753
N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119714810
N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119700164
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-(3-carbamoyl-4-chlorophenyl)morpholine-2-carboxamide;hydrochloride
CID 119711589
N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]morpholine-2-carboxamide
CID 119858998
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119794532
N-[3-(carbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119702027
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide
CID 119794533
N-(3-butoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119745760

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride (CID 119709306) is N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride is Cl.NC(=O)COc1ccc(NC(=O)C2CNCCO2)cc1.
What is the InChIKey of N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is RFGMLPAUSJSBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O4.ClH/c14-12(17)8-20-10-3-1-9(2-4-10)16-13(18)11-7-15-5-6-19-11;/h1-4,11,15H,5-8H2,(H2,14,17)(H,16,18);1H.
What are the key properties of N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 315.76 g/mol, XLogP of -0.10, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119709306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).