N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride

C13H25ClN2O2 — CID 119717323

IUPACN-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride
SMILESCC1CCCC(N(C)C(=O)C2CNCCO2)C1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10-4-3-5-11(8-10)15(2)13(16)12-9-14-6-7-17-12;/h10-12,14H,3-9H2,1-2H3;1H
InChIKeyLGHVOBIFMJDDGL-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.43
Rot. Bonds2

About N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride

N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119717323) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119717323
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride
SMILESCC1CCCC(N(C)C(=O)C2CNCCO2)C1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10-4-3-5-11(8-10)15(2)13(16)12-9-14-6-7-17-12;/h10-12,14H,3-9H2,1-2H3;1H
InChIKeyLGHVOBIFMJDDGL-UHFFFAOYSA-N
XLogP1.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride (CID 119717323) is N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride is CC1CCCC(N(C)C(=O)C2CNCCO2)C1.Cl.
What is the InChIKey of N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is LGHVOBIFMJDDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-10-4-3-5-11(8-10)15(2)13(16)12-9-14-6-7-17-12;/h10-12,14H,3-9H2,1-2H3;1H.
What are the key properties of N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride?
N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylcyclohexyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119717323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).