(1-methylcyclohexyl)-morpholin-4-ylmethanone

C12H21NO2 — CID 1103446

IUPAC(1-methylcyclohexyl)-morpholin-4-ylmethanone
SMILESCC1(C(=O)N2CCOCC2)CCCCC1
InChIInChI=1S/C12H21NO2/c1-12(5-3-2-4-6-12)11(14)13-7-9-15-10-8-13/h2-10H2,1H3
InChIKeyJTFWPQAIGRJJAI-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.82
Rot. Bonds1

About (1-methylcyclohexyl)-morpholin-4-ylmethanone

(1-methylcyclohexyl)-morpholin-4-ylmethanone (PubChem CID 1103446) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is (1-methylcyclohexyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(1-methylcyclohexyl)-morpholin-4-ylmethanone
PubChem CID1103446
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name(1-methylcyclohexyl)-morpholin-4-ylmethanone
SMILESCC1(C(=O)N2CCOCC2)CCCCC1
InChIInChI=1S/C12H21NO2/c1-12(5-3-2-4-6-12)11(14)13-7-9-15-10-8-13/h2-10H2,1H3
InChIKeyJTFWPQAIGRJJAI-UHFFFAOYSA-N
XLogP1.82
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 531815
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CID 202710
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CID 202711
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CID 887288
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CID 99197
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CID 200760
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CID 208727
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Frequently Asked Questions

What is the IUPAC name of (1-methylcyclohexyl)-morpholin-4-ylmethanone?
The IUPAC name of (1-methylcyclohexyl)-morpholin-4-ylmethanone (CID 1103446) is (1-methylcyclohexyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (1-methylcyclohexyl)-morpholin-4-ylmethanone?
The canonical SMILES for (1-methylcyclohexyl)-morpholin-4-ylmethanone is CC1(C(=O)N2CCOCC2)CCCCC1.
What is the InChIKey of (1-methylcyclohexyl)-morpholin-4-ylmethanone?
The InChIKey is JTFWPQAIGRJJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-12(5-3-2-4-6-12)11(14)13-7-9-15-10-8-13/h2-10H2,1H3.
What are the key properties of (1-methylcyclohexyl)-morpholin-4-ylmethanone?
(1-methylcyclohexyl)-morpholin-4-ylmethanone has a molecular weight of 211.30 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylcyclohexyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 1103446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).