molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide

C18H22N2O3 — CID 143052664

IUPACmolecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)N1CCOCC1.[H][H]
InChIInChI=1S/C18H20N2O3.H2/c21-18(20-10-12-22-13-11-20)19-16-6-8-17(9-7-16)23-14-15-4-2-1-3-5-15;/h1-9H,10-14H2,(H,19,21);1H
InChIKeyQOUGFNOSNGBMEH-UHFFFAOYSA-N
MW314.38 g/mol
LogP3.38
Rot. Bonds4

About molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide

molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide (PubChem CID 143052664) has the molecular formula C18H22N2O3 and a molecular weight of 314.38 g/mol. Its IUPAC name is molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound Namemolecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide
PubChem CID143052664
Molecular FormulaC18H22N2O3
Molecular Weight314.38 g/mol
Exact Mass314.16
IUPAC Namemolecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)N1CCOCC1.[H][H]
InChIInChI=1S/C18H20N2O3.H2/c21-18(20-10-12-22-13-11-20)19-16-6-8-17(9-7-16)23-14-15-4-2-1-3-5-15;/h1-9H,10-14H2,(H,19,21);1H
InChIKeyQOUGFNOSNGBMEH-UHFFFAOYSA-N
XLogP3.38
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetyl-N-(4-phenylmethoxyphenyl)piperazine-1-carboxamide
CID 108988713
4-(5-bromopyrimidin-2-yl)-N-(4-phenylmethoxyphenyl)piperazine-1-carboxamide
CID 58462419
4-(2-methoxyphenyl)-N-(4-phenylmethoxyphenyl)piperazine-1-carboxamide
CID 24825192
N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide
CID 71370344
2-(morpholine-4-carbonyl)-3-(4-phenylmethoxyanilino)prop-2-enenitrile
CID 4603539
N-[3-[(3-cyanophenyl)methoxy]phenyl]morpholine-4-carboxamide
CID 47042118
4-(2,4-dimethoxyphenyl)-N-(4-phenylmethoxyphenyl)piperazine-1-carboxamide
CID 3756709
(2-morpholin-4-yl-2-oxoethyl) 4-phenylmethoxybenzoate
CID 2607617
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]thiomorpholine-4-carboxamide
CID 118776743
[2-[4-(morpholin-4-ylmethyl)anilino]-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 24518315
N-(4-phenylmethoxyphenyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 58346268
4-(3-cyanopyridin-1-ium-2-yl)-N-(4-phenylmethoxyphenyl)piperazine-1-carboxamide
CID 7189487

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide?
The IUPAC name of molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide (CID 143052664) is molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide.
What is the SMILES notation for molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide?
The canonical SMILES for molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide is O=C(Nc1ccc(OCc2ccccc2)cc1)N1CCOCC1.[H][H].
What is the InChIKey of molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide?
The InChIKey is QOUGFNOSNGBMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3.H2/c21-18(20-10-12-22-13-11-20)19-16-6-8-17(9-7-16)23-14-15-4-2-1-3-5-15;/h1-9H,10-14H2,(H,19,21);1H.
What are the key properties of molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide?
molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide has a molecular weight of 314.38 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 143052664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).