2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid

C15H26N2O4 — CID 66433858

IUPAC2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
SMILESCCN(C(=O)N1CCOC(CC(=O)O)C1)C1CCCCC1
InChIInChI=1S/C15H26N2O4/c1-2-17(12-6-4-3-5-7-12)15(20)16-8-9-21-13(11-16)10-14(18)19/h12-13H,2-11H2,1H3,(H,18,19)
InChIKeyZQCUZKGRCVBKBQ-UHFFFAOYSA-N
MW298.38 g/mol
LogP1.94
Rot. Bonds4

About 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid

2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid (PubChem CID 66433858) has the molecular formula C15H26N2O4 and a molecular weight of 298.38 g/mol. Its IUPAC name is 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
PubChem CID66433858
Molecular FormulaC15H26N2O4
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC Name2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
SMILESCCN(C(=O)N1CCOC(CC(=O)O)C1)C1CCCCC1
InChIInChI=1S/C15H26N2O4/c1-2-17(12-6-4-3-5-7-12)15(20)16-8-9-21-13(11-16)10-14(18)19/h12-13H,2-11H2,1H3,(H,18,19)
InChIKeyZQCUZKGRCVBKBQ-UHFFFAOYSA-N
XLogP1.94
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(diethylcarbamoyl)morpholin-2-yl]acetic acid
CID 66435597
2-[4-[butyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
CID 66435406
2-[1-[cyclohexyl(ethyl)carbamoyl]azetidin-3-yl]acetic acid
CID 64618408
2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid
CID 62691355
2-[4-[3-(dimethylamino)propyl-ethylcarbamoyl]morpholin-2-yl]acetic acid
CID 102995442
3-[cyclopropyl-(2-ethylmorpholine-4-carbonyl)amino]propanoic acid
CID 61202092
2-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]morpholin-2-yl]acetic acid
CID 66434691
2-[4-[2-cyanoethyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
CID 66433326
2-[(2R)-4-[3-[(2R)-oxan-2-yl]propanoyl]morpholin-2-yl]acetic acid
CID 124515315
2-[(2R)-4-[3-[(2S)-oxan-2-yl]propanoyl]morpholin-2-yl]acetic acid
CID 124515314
2-[4-(2-pentoxyacetyl)morpholin-2-yl]acetic acid
CID 119247634
2-(4-cyclohexylmorpholin-2-yl)acetic acid
CID 66433671

Frequently Asked Questions

What is the IUPAC name of 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid (CID 66433858) is 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid is CCN(C(=O)N1CCOC(CC(=O)O)C1)C1CCCCC1.
What is the InChIKey of 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid?
The InChIKey is ZQCUZKGRCVBKBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O4/c1-2-17(12-6-4-3-5-7-12)15(20)16-8-9-21-13(11-16)10-14(18)19/h12-13H,2-11H2,1H3,(H,18,19).
What are the key properties of 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid?
2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid has a molecular weight of 298.38 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid is sourced from PubChem (CID 66433858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).