N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride

C19H31ClN2O3 — CID 119778685

IUPACN-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride
SMILESCC(C)COc1ccc(C(C)(C)CNC(=O)C2CNCCO2)cc1.Cl
InChIInChI=1S/C19H30N2O3.ClH/c1-14(2)12-24-16-7-5-15(6-8-16)19(3,4)13-21-18(22)17-11-20-9-10-23-17;/h5-8,14,17,20H,9-13H2,1-4H3,(H,21,22);1H
InChIKeyXKHCEWXOCZKPLA-UHFFFAOYSA-N
MW370.92 g/mol
LogP2.53
Rot. Bonds7

About N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride

N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119778685) has the molecular formula C19H31ClN2O3 and a molecular weight of 370.92 g/mol. Its IUPAC name is N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119778685
Molecular FormulaC19H31ClN2O3
Molecular Weight370.92 g/mol
Exact Mass370.20
IUPAC NameN-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride
SMILESCC(C)COc1ccc(C(C)(C)CNC(=O)C2CNCCO2)cc1.Cl
InChIInChI=1S/C19H30N2O3.ClH/c1-14(2)12-24-16-7-5-15(6-8-16)19(3,4)13-21-18(22)17-11-20-9-10-23-17;/h5-8,14,17,20H,9-13H2,1-4H3,(H,21,22);1H
InChIKeyXKHCEWXOCZKPLA-UHFFFAOYSA-N
XLogP2.53
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.92
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]piperidine-3-carboxamide;hydrochloride
CID 119320715
N-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]morpholine-2-carboxamide
CID 119760050
N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119787672
(2S)-2-amino-3-methyl-N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]butanamide
CID 86813594
N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]-2-pyrrolidin-2-ylacetamide
CID 119778688
3-amino-2-methyl-N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]butanamide;hydrochloride
CID 120500609
N-[2-(4-fluorophenoxy)propyl]morpholine-2-carboxamide
CID 119804499
2-(cyclopropylmethylamino)-N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]acetamide
CID 119778674
N-[2-(4-bromophenyl)sulfanyl-2-methylpropyl]morpholine-2-carboxamide;hydrochloride
CID 119806742
N-[4-(2,2,2-trifluoroethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119698644
N-[(4-propoxyphenyl)methyl]morpholine-2-carboxamide
CID 119714378
N-[2-(4-bromophenoxy)ethyl]morpholine-2-carboxamide
CID 119757535

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride (CID 119778685) is N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride is CC(C)COc1ccc(C(C)(C)CNC(=O)C2CNCCO2)cc1.Cl.
What is the InChIKey of N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is XKHCEWXOCZKPLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3.ClH/c1-14(2)12-24-16-7-5-15(6-8-16)19(3,4)13-21-18(22)17-11-20-9-10-23-17;/h5-8,14,17,20H,9-13H2,1-4H3,(H,21,22);1H.
What are the key properties of N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride?
N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 370.92 g/mol, XLogP of 2.53, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119778685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).