N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride

C15H23ClN2O3 — CID 119792290

IUPACN-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCC(C)(C)Oc1ccccc1NC(=O)C1CNCCO1.Cl
InChIInChI=1S/C15H22N2O3.ClH/c1-15(2,3)20-12-7-5-4-6-11(12)17-14(18)13-10-16-8-9-19-13;/h4-7,13,16H,8-10H2,1-3H3,(H,17,18);1H
InChIKeyMJYJEAJKADHTCK-UHFFFAOYSA-N
MW314.81 g/mol
LogP2.21
Rot. Bonds3

About N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride

N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119792290) has the molecular formula C15H23ClN2O3 and a molecular weight of 314.81 g/mol. Its IUPAC name is N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119792290
Molecular FormulaC15H23ClN2O3
Molecular Weight314.81 g/mol
Exact Mass314.14
IUPAC NameN-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCC(C)(C)Oc1ccccc1NC(=O)C1CNCCO1.Cl
InChIInChI=1S/C15H22N2O3.ClH/c1-15(2,3)20-12-7-5-4-6-11(12)17-14(18)13-10-16-8-9-19-13;/h4-7,13,16H,8-10H2,1-3H3,(H,17,18);1H
InChIKeyMJYJEAJKADHTCK-UHFFFAOYSA-N
XLogP2.21
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.81
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-phenylethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119792514
N-(2-methylsulfanylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119674752
N-(2-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679075
N-(3-chloro-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119671790
N-[2-(2,2,2-trifluoroethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119801569
N-(2,4,5-trimethoxyphenyl)morpholine-2-carboxamide
CID 119808138
N-(2,5-dimethoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119674283
N-(4-methoxy-2,3-dimethylphenyl)morpholine-2-carboxamide
CID 115177389
N-(4,5-dimethoxy-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679112
N-[2-(pyrrolidine-1-carbonylamino)phenyl]morpholine-2-carboxamide
CID 119736053
N-(4-chloro-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119671690
N-(5-bromo-2-methoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119729353

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride (CID 119792290) is N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride is CC(C)(C)Oc1ccccc1NC(=O)C1CNCCO1.Cl.
What is the InChIKey of N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is MJYJEAJKADHTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3.ClH/c1-15(2,3)20-12-7-5-4-6-11(12)17-14(18)13-10-16-8-9-19-13;/h4-7,13,16H,8-10H2,1-3H3,(H,17,18);1H.
What are the key properties of N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride?
N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 314.81 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119792290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).