N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide

C19H28N2O3 — CID 119797837

IUPACN-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide
SMILESCc1ccc(NC(=O)C2COCCN2)cc1OCC1CCCCC1
InChIInChI=1S/C19H28N2O3/c1-14-7-8-16(21-19(22)17-13-23-10-9-20-17)11-18(14)24-12-15-5-3-2-4-6-15/h7-8,11,15,17,20H,2-6,9-10,12-13H2,1H3,(H,21,22)
InChIKeyOSXACQVCIPQGBL-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.88
Rot. Bonds5

About N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide

N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide (PubChem CID 119797837) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide
PubChem CID119797837
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide
SMILESCc1ccc(NC(=O)C2COCCN2)cc1OCC1CCCCC1
InChIInChI=1S/C19H28N2O3/c1-14-7-8-16(21-19(22)17-13-23-10-9-20-17)11-18(14)24-12-15-5-3-2-4-6-15/h7-8,11,15,17,20H,2-6,9-10,12-13H2,1H3,(H,21,22)
InChIKeyOSXACQVCIPQGBL-UHFFFAOYSA-N
XLogP2.88
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
4-hydroxy-N-[4-methyl-3-(oxan-4-ylmethoxy)phenyl]pyrrolidine-2-carboxamide
CID 119797799
N-[4-methyl-3-[(4-methyl-2-pyridinyl)oxy]phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119891518
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-(4-ethoxy-3-fluorophenyl)morpholine-3-carboxamide
CID 112701655
N-[3-(dimethylamino)-4-methylphenyl]morpholine-3-carboxamide
CID 115377301
N-[3-methyl-4-(2,2,2-trifluoroethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119794822
2-[[4-methyl-3-(oxan-4-ylmethoxy)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120976327
N-(3-ethyl-4-methoxyphenyl)morpholine-3-carboxamide
CID 115177545
N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]morpholine-3-carboxamide
CID 119675117
N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)morpholine-3-carboxamide
CID 119688738
N-[3-[2-(cyclopropylamino)-2-oxoethoxy]-4-methoxyphenyl]morpholine-3-carboxamide;hydrochloride
CID 119717546

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide?
The IUPAC name of N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide (CID 119797837) is N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide?
The canonical SMILES for N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide is Cc1ccc(NC(=O)C2COCCN2)cc1OCC1CCCCC1.
What is the InChIKey of N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide?
The InChIKey is OSXACQVCIPQGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-14-7-8-16(21-19(22)17-13-23-10-9-20-17)11-18(14)24-12-15-5-3-2-4-6-15/h7-8,11,15,17,20H,2-6,9-10,12-13H2,1H3,(H,21,22).
What are the key properties of N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide?
N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide has a molecular weight of 332.44 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclohexylmethoxy)-4-methylphenyl]morpholine-3-carboxamide is sourced from PubChem (CID 119797837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).