2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one

C15H28N2O2 — CID 55013356

IUPAC2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCC1CCCCC1C)C(=O)N1CCOCC1
InChIInChI=1S/C15H28N2O2/c1-12-5-3-4-6-14(12)11-16-13(2)15(18)17-7-9-19-10-8-17/h12-14,16H,3-11H2,1-2H3
InChIKeyKNYXBHUSNXGKOK-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds4

About 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one

2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one (PubChem CID 55013356) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one
PubChem CID55013356
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCC1CCCCC1C)C(=O)N1CCOCC1
InChIInChI=1S/C15H28N2O2/c1-12-5-3-4-6-14(12)11-16-13(2)15(18)17-7-9-19-10-8-17/h12-14,16H,3-11H2,1-2H3
InChIKeyKNYXBHUSNXGKOK-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methylcyclopentyl)methylamino]-1-piperidin-1-ylpropan-1-one
CID 107418174
(2R)-1-morpholin-4-yl-2-[[(2R)-oxolan-2-yl]methylamino]propan-1-one
CID 1439822
1-morpholin-4-yl-2-(oxan-3-ylmethylamino)propan-1-one
CID 54905983
2-(cyclopentylamino)-1-morpholin-4-ylpropan-1-one
CID 43083614
2-[(2-methylcyclohexyl)methylamino]-N-propan-2-ylpropanamide
CID 55013491
(2S)-2-(cyclohexylamino)-1-morpholin-4-ylpropan-1-one
CID 51675158
2-[2-[cyclopentyl(methyl)amino]ethylamino]-1-morpholin-4-ylpropan-1-one
CID 63318437
2-[[(1S)-1-cyclopentylethyl]amino]-1-morpholin-4-ylpropan-1-one
CID 81395367
2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]-1-morpholin-4-ylpropan-1-one
CID 115588959
2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-1-morpholin-4-ylpropan-1-one
CID 102731617
2-[[(1S)-1-cycloheptylethyl]amino]-1-morpholin-4-ylpropan-1-one
CID 81392361
(2S)-1-morpholin-4-yl-2-[[(2R)-1-pyridazin-3-ylpyrrolidin-2-yl]methylamino]propan-1-one
CID 129370384

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one (CID 55013356) is 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one is CC(NCC1CCCCC1C)C(=O)N1CCOCC1.
What is the InChIKey of 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is KNYXBHUSNXGKOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12-5-3-4-6-14(12)11-16-13(2)15(18)17-7-9-19-10-8-17/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one?
2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 268.40 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylcyclohexyl)methylamino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 55013356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).