N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide

C17H23N3O4 — CID 119712459

IUPACN-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide
SMILESO=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C1COCCN1
InChIInChI=1S/C17H23N3O4/c21-16(20-6-9-23-10-7-20)11-13-1-3-14(4-2-13)19-17(22)15-12-24-8-5-18-15/h1-4,15,18H,5-12H2,(H,19,22)
InChIKeyYYGNGNSGUGQVMZ-UHFFFAOYSA-N
MW333.39 g/mol
LogP0.01
Rot. Bonds4

About N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide

N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide (PubChem CID 119712459) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide
PubChem CID119712459
Molecular FormulaC17H23N3O4
Molecular Weight333.39 g/mol
Exact Mass333.17
IUPAC NameN-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide
SMILESO=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C1COCCN1
InChIInChI=1S/C17H23N3O4/c21-16(20-6-9-23-10-7-20)11-13-1-3-14(4-2-13)19-17(22)15-12-24-8-5-18-15/h1-4,15,18H,5-12H2,(H,19,22)
InChIKeyYYGNGNSGUGQVMZ-UHFFFAOYSA-N
XLogP0.01
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119899006
N-[4-(azepan-1-ylmethyl)phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119867908
N-[4-(azepane-1-carbonylamino)phenyl]morpholine-3-carboxamide
CID 119761499
N-[4-(2-methylpropyl)phenyl]morpholine-3-carboxamide
CID 115177537
N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide
CID 119712313
N-[4-(2-methylpropanoylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119685241
3-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]cyclopentane-1-carboxamide
CID 119712465
1-[[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 120549290
N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119866777
N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]-2-thiomorpholin-3-ylacetamide
CID 119936357
N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide
CID 119754209
2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]butanamide
CID 46455504

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide?
The IUPAC name of N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide (CID 119712459) is N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide?
The canonical SMILES for N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide is O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C1COCCN1.
What is the InChIKey of N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide?
The InChIKey is YYGNGNSGUGQVMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4/c21-16(20-6-9-23-10-7-20)11-13-1-3-14(4-2-13)19-17(22)15-12-24-8-5-18-15/h1-4,15,18H,5-12H2,(H,19,22).
What are the key properties of N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide?
N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide is sourced from PubChem (CID 119712459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).