N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride

C13H25ClN2O2 — CID 119750252

IUPACN-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride
SMILESCC1CCCC(CNC(=O)C2COCCN2)C1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10-3-2-4-11(7-10)8-15-13(16)12-9-17-6-5-14-12;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyBACBYYOQVUINIW-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.34
Rot. Bonds3

About N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride

N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119750252) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119750252
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride
SMILESCC1CCCC(CNC(=O)C2COCCN2)C1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10-3-2-4-11(7-10)8-15-13(16)12-9-17-6-5-14-12;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyBACBYYOQVUINIW-UHFFFAOYSA-N
XLogP1.34
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 ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
CID 119741853
4-methyl-N-[(3-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114130671
(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 107413261
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
N-[2-(cyclobutylmethylsulfamoyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119782528
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119785395
N-[2-(3-methylpiperidin-1-yl)ethyl]morpholine-3-carboxamide;dihydrochloride
CID 119850990
4-methoxy-N-[(3-methylcyclohexyl)methyl]pyrrolidine-2-carboxamide
CID 103832995
N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]morpholine-3-carboxamide;dihydrochloride
CID 119898858
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide
CID 103811312
N-[2-(3-methylpiperidin-1-yl)ethyl]morpholine-3-carboxamide
CID 119850991
N-(2-methylcyclohexyl)morpholine-3-carboxamide;hydrochloride
CID 119676476

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride (CID 119750252) is N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride is CC1CCCC(CNC(=O)C2COCCN2)C1.Cl.
What is the InChIKey of N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is BACBYYOQVUINIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-10-3-2-4-11(7-10)8-15-13(16)12-9-17-6-5-14-12;/h10-12,14H,2-9H2,1H3,(H,15,16);1H.
What are the key properties of N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride?
N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119750252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).