2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide

C15H29N3O2 — CID 81217117

IUPAC2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide
SMILESCC1COC(CN)CN1C(C)C(=O)NC1CCCCC1
InChIInChI=1S/C15H29N3O2/c1-11-10-20-14(8-16)9-18(11)12(2)15(19)17-13-6-4-3-5-7-13/h11-14H,3-10,16H2,1-2H3,(H,17,19)
InChIKeyHRURCVMOVOYKLR-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.87
Rot. Bonds4

About 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide

2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide (PubChem CID 81217117) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide
PubChem CID81217117
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide
SMILESCC1COC(CN)CN1C(C)C(=O)NC1CCCCC1
InChIInChI=1S/C15H29N3O2/c1-11-10-20-14(8-16)9-18(11)12(2)15(19)17-13-6-4-3-5-7-13/h11-14H,3-10,16H2,1-2H3,(H,17,19)
InChIKeyHRURCVMOVOYKLR-UHFFFAOYSA-N
XLogP0.87
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-methylpropanamide
CID 81216899
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-ethylpropanamide
CID 81217224
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-(methylcarbamoyl)propanamide
CID 81217822
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-(2-methoxyethyl)propanamide
CID 81218040
2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide
CID 61338383
1-[2-(aminomethyl)-5-methylmorpholin-4-yl]-2-cyclopropylpropan-1-one
CID 83151811
N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide
CID 81195909
(4-cyclohexyl-5-methylmorpholin-2-yl)methanamine
CID 81217618
3-methylbutyl N-cyclohexylcarbamate
CID 86243713
N-[4-(aminomethyl)phenyl]-2-(2,5-dimethylmorpholin-4-yl)propanamide
CID 43544268
N-cyclohexyl-2-(4-ethyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)propanamide
CID 66208739
1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-2-methylpiperidine-4-carboxylic acid
CID 106745113

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide?
The IUPAC name of 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide (CID 81217117) is 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide.
What is the SMILES notation for 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide?
The canonical SMILES for 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide is CC1COC(CN)CN1C(C)C(=O)NC1CCCCC1.
What is the InChIKey of 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide?
The InChIKey is HRURCVMOVOYKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-11-10-20-14(8-16)9-18(11)12(2)15(19)17-13-6-4-3-5-7-13/h11-14H,3-10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide?
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide has a molecular weight of 283.42 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide is sourced from PubChem (CID 81217117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).