N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide

C19H22N2O3 — CID 119783770

IUPACN-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide
SMILESCc1cccc(COc2cccc(NC(=O)C3CNCCO3)c2)c1
InChIInChI=1S/C19H22N2O3/c1-14-4-2-5-15(10-14)13-24-17-7-3-6-16(11-17)21-19(22)18-12-20-8-9-23-18/h2-7,10-11,18,20H,8-9,12-13H2,1H3,(H,21,22)
InChIKeyOTLDACFSFOJJBQ-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.50
Rot. Bonds5

About N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide

N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide (PubChem CID 119783770) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide
PubChem CID119783770
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide
SMILESCc1cccc(COc2cccc(NC(=O)C3CNCCO3)c2)c1
InChIInChI=1S/C19H22N2O3/c1-14-4-2-5-15(10-14)13-24-17-7-3-6-16(11-17)21-19(22)18-12-20-8-9-23-18/h2-7,10-11,18,20H,8-9,12-13H2,1H3,(H,21,22)
InChIKeyOTLDACFSFOJJBQ-UHFFFAOYSA-N
XLogP2.50
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1,3-benzodioxol-5-yloxymethyl)phenyl]morpholine-2-carboxamide
CID 119729240
N-(3-butoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119745760
N-[3-[(3-methylphenyl)methoxy]phenyl]piperidine-3-carboxamide;hydrochloride
CID 119323699
N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119846119
N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675709
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-2-carboxamide
CID 119713878
N-[[3-[(3-methylphenyl)carbamoylamino]phenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119719704
N-[3-(2-butoxyethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119754344
N-[3-(tert-butylsulfinylmethyl)phenyl]morpholine-2-carboxamide
CID 119790021
N-[2-[4-[2-(3-methylanilino)-2-oxoethoxy]phenyl]ethyl]morpholine-2-carboxamide
CID 119750855
N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
CID 119755895
N-[3-(carbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119702027

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide?
The IUPAC name of N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide (CID 119783770) is N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide is Cc1cccc(COc2cccc(NC(=O)C3CNCCO3)c2)c1.
What is the InChIKey of N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide?
The InChIKey is OTLDACFSFOJJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-14-4-2-5-15(10-14)13-24-17-7-3-6-16(11-17)21-19(22)18-12-20-8-9-23-18/h2-7,10-11,18,20H,8-9,12-13H2,1H3,(H,21,22).
What are the key properties of N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide?
N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119783770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).