4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide

C14H26N2O3 — CID 136519716

IUPAC4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide
SMILESCC1CCCCC1OCCN1CCOCC1C(N)=O
InChIInChI=1S/C14H26N2O3/c1-11-4-2-3-5-13(11)19-9-7-16-6-8-18-10-12(16)14(15)17/h11-13H,2-10H2,1H3,(H2,15,17)
InChIKeyNCIDPWWQQACJJS-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.77
Rot. Bonds5

About 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide

4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide (PubChem CID 136519716) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide
PubChem CID136519716
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide
SMILESCC1CCCCC1OCCN1CCOCC1C(N)=O
InChIInChI=1S/C14H26N2O3/c1-11-4-2-3-5-13(11)19-9-7-16-6-8-18-10-12(16)14(15)17/h11-13H,2-10H2,1H3,(H2,15,17)
InChIKeyNCIDPWWQQACJJS-UHFFFAOYSA-N
XLogP0.77
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide?
The IUPAC name of 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide (CID 136519716) is 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide is CC1CCCCC1OCCN1CCOCC1C(N)=O.
What is the InChIKey of 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide?
The InChIKey is NCIDPWWQQACJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-11-4-2-3-5-13(11)19-9-7-16-6-8-18-10-12(16)14(15)17/h11-13H,2-10H2,1H3,(H2,15,17).
What are the key properties of 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide?
4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylcyclohexyl)oxyethyl]morpholine-3-carboxamide is sourced from PubChem (CID 136519716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).