N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride

C13H21ClN2O2S — CID 119787672

IUPACN-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride
SMILESCC(C)(CNC(=O)C1CNCCO1)c1cccs1.Cl
InChIInChI=1S/C13H20N2O2S.ClH/c1-13(2,11-4-3-7-18-11)9-15-12(16)10-8-14-5-6-17-10;/h3-4,7,10,14H,5-6,8-9H2,1-2H3,(H,15,16);1H
InChIKeyNOYXILHZYRTXAJ-UHFFFAOYSA-N
MW304.84 g/mol
LogP1.55
Rot. Bonds4

About N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride

N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119787672) has the molecular formula C13H21ClN2O2S and a molecular weight of 304.84 g/mol. Its IUPAC name is N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119787672
Molecular FormulaC13H21ClN2O2S
Molecular Weight304.84 g/mol
Exact Mass304.10
IUPAC NameN-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride
SMILESCC(C)(CNC(=O)C1CNCCO1)c1cccs1.Cl
InChIInChI=1S/C13H20N2O2S.ClH/c1-13(2,11-4-3-7-18-11)9-15-12(16)10-8-14-5-6-17-10;/h3-4,7,10,14H,5-6,8-9H2,1-2H3,(H,15,16);1H
InChIKeyNOYXILHZYRTXAJ-UHFFFAOYSA-N
XLogP1.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.84
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-2-thiophen-2-ylpropyl)piperidine-4-carboxamide
CID 80527272
N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-3-carboxamide;hydrochloride
CID 119787636
N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]morpholine-2-carboxamide;hydrochloride
CID 119778685
N-[3-(thiophene-2-carbonylamino)propyl]morpholine-2-carboxamide
CID 119764480
N-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]morpholine-2-carboxamide
CID 119760050
2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyrrolidine-3-carboxamide
CID 80527266
N-[(1R)-1-thiophen-2-ylethyl]morpholine-2-carboxamide
CID 81408817
N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide
CID 106147940
N-[2-(4-bromophenyl)sulfanyl-2-methylpropyl]morpholine-2-carboxamide;hydrochloride
CID 119806742
cis-(1R,2S)-2-[(2-methyl-2-thiophen-2-ylpropyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 124571467
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]morpholine-2-carboxamide;dihydrochloride
CID 119850057
N-(2-methyl-2-thiophen-2-ylpropyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119787657

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride (CID 119787672) is N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride is CC(C)(CNC(=O)C1CNCCO1)c1cccs1.Cl.
What is the InChIKey of N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is NOYXILHZYRTXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S.ClH/c1-13(2,11-4-3-7-18-11)9-15-12(16)10-8-14-5-6-17-10;/h3-4,7,10,14H,5-6,8-9H2,1-2H3,(H,15,16);1H.
What are the key properties of N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride?
N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 304.84 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119787672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).