N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride

C13H25ClN2O2 — CID 119705705

IUPACN-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride
SMILESCC(NC(=O)C1COCCN1)C1CCCCC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10(11-5-3-2-4-6-11)15-13(16)12-9-17-8-7-14-12;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyMQHGYHLDLNFBOT-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.48
Rot. Bonds3

About N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride

N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119705705) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119705705
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride
SMILESCC(NC(=O)C1COCCN1)C1CCCCC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10(11-5-3-2-4-6-11)15-13(16)12-9-17-8-7-14-12;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyMQHGYHLDLNFBOT-UHFFFAOYSA-N
XLogP1.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 130674305
N-[(2R)-1-hydroxypropan-2-yl]morpholine-3-carboxamide
CID 107218691
N-(4-hydroxybutan-2-yl)morpholine-3-carboxamide
CID 83177558
(2R,3S)-N-(1-cyclohexylethyl)-2-methylmorpholine-3-carboxamide
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N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride (CID 119705705) is N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride is CC(NC(=O)C1COCCN1)C1CCCCC1.Cl.
What is the InChIKey of N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is MQHGYHLDLNFBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-10(11-5-3-2-4-6-11)15-13(16)12-9-17-8-7-14-12;/h10-12,14H,2-9H2,1H3,(H,15,16);1H.
What are the key properties of N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride?
N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119705705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).