N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride

C12H17ClN2O2 — CID 119670966

IUPACN-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2CNCCO2)cc1.Cl
InChIInChI=1S/C12H16N2O2.ClH/c1-9-2-4-10(5-3-9)14-12(15)11-8-13-6-7-16-11;/h2-5,11,13H,6-8H2,1H3,(H,14,15);1H
InChIKeyDTKXFSXATRFCRC-UHFFFAOYSA-N
MW256.73 g/mol
LogP1.34
Rot. Bonds2

About N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride

N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119670966) has the molecular formula C12H17ClN2O2 and a molecular weight of 256.73 g/mol. Its IUPAC name is N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119670966
Molecular FormulaC12H17ClN2O2
Molecular Weight256.73 g/mol
Exact Mass256.10
IUPAC NameN-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2CNCCO2)cc1.Cl
InChIInChI=1S/C12H16N2O2.ClH/c1-9-2-4-10(5-3-9)14-12(15)11-8-13-6-7-16-11;/h2-5,11,13H,6-8H2,1H3,(H,14,15);1H
InChIKeyDTKXFSXATRFCRC-UHFFFAOYSA-N
XLogP1.34
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119700164
2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 80549799
N-(4-pentylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119686937
N-[4-[3-(dimethylamino)propanoylamino]phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119868290
N-(2-fluoro-4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675290
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119714810
N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]morpholine-2-carboxamide
CID 119700062
N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide
CID 119762149
N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide
CID 119739016
N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119709306
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119794532

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride (CID 119670966) is N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride is Cc1ccc(NC(=O)C2CNCCO2)cc1.Cl.
What is the InChIKey of N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is DTKXFSXATRFCRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2.ClH/c1-9-2-4-10(5-3-9)14-12(15)11-8-13-6-7-16-11;/h2-5,11,13H,6-8H2,1H3,(H,14,15);1H.
What are the key properties of N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 256.73 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119670966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).