N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide

C12H22N2O3 — CID 103768181

IUPACN-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
SMILESCC(NC(=O)N1CCOCC1)C1CCOCC1
InChIInChI=1S/C12H22N2O3/c1-10(11-2-6-16-7-3-11)13-12(15)14-4-8-17-9-5-14/h10-11H,2-9H2,1H3,(H,13,15)
InChIKeyVLQVQLBZGCOAIG-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.84
Rot. Bonds2

About N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide

N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide (PubChem CID 103768181) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
PubChem CID103768181
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
SMILESCC(NC(=O)N1CCOCC1)C1CCOCC1
InChIInChI=1S/C12H22N2O3/c1-10(11-2-6-16-7-3-11)13-12(15)14-4-8-17-9-5-14/h10-11H,2-9H2,1H3,(H,13,15)
InChIKeyVLQVQLBZGCOAIG-UHFFFAOYSA-N
XLogP0.84
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[1-(oxan-4-yl)ethyl]piperidine-1-carboxamide
CID 113258503
N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide
CID 103977253
1-[1-(oxan-4-yl)ethylcarbamoyl]pyrrolidine-3-carboxylic acid
CID 114115277
N-propan-2-ylmorpholine-4-carboxamide
CID 3411412
N-(1-cyclopropylpropan-2-yl)morpholine-4-carboxamide
CID 115624308
N-[1-(oxan-4-yl)ethyl]cyclopropanecarboxamide
CID 103769201
(2S)-2-ethyl-2-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]morpholine-4-carboxamide
CID 99857632
(3S)-1-[1-(oxolan-3-yl)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 104876966
N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide
CID 97070572
2-[4-(1-cyclopropylethylcarbamoyl)morpholin-2-yl]acetic acid
CID 66435617
3-methyl-2-(morpholine-4-carbonylamino)butanoyl iodide
CID 129144228
N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-1-carboxamide
CID 116657750

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide?
The IUPAC name of N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide (CID 103768181) is N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide is CC(NC(=O)N1CCOCC1)C1CCOCC1.
What is the InChIKey of N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide?
The InChIKey is VLQVQLBZGCOAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-10(11-2-6-16-7-3-11)13-12(15)14-4-8-17-9-5-14/h10-11H,2-9H2,1H3,(H,13,15).
What are the key properties of N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide?
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 103768181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).