2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid

C14H26N2O4 — CID 61447344

IUPAC2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid
SMILESCCN(CCOC)C(=O)NC(C(=O)O)C1CCCCC1
InChIInChI=1S/C14H26N2O4/c1-3-16(9-10-20-2)14(19)15-12(13(17)18)11-7-5-4-6-8-11/h11-12H,3-10H2,1-2H3,(H,15,19)(H,17,18)
InChIKeyLDFZEDJAWNAJRD-UHFFFAOYSA-N
MW286.37 g/mol
LogP1.70
Rot. Bonds7

About 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid

2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid (PubChem CID 61447344) has the molecular formula C14H26N2O4 and a molecular weight of 286.37 g/mol. Its IUPAC name is 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid.

Molecular Properties

Compound Name2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid
PubChem CID61447344
Molecular FormulaC14H26N2O4
Molecular Weight286.37 g/mol
Exact Mass286.19
IUPAC Name2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid
SMILESCCN(CCOC)C(=O)NC(C(=O)O)C1CCCCC1
InChIInChI=1S/C14H26N2O4/c1-3-16(9-10-20-2)14(19)15-12(13(17)18)11-7-5-4-6-8-11/h11-12H,3-10H2,1-2H3,(H,15,19)(H,17,18)
InChIKeyLDFZEDJAWNAJRD-UHFFFAOYSA-N
XLogP1.70
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid
CID 62709513
2-cyclohexyl-2-[[ethyl(2-methylpropyl)carbamoyl]amino]acetic acid
CID 61197769
2-cyclohexyl-2-[[ethyl-(2-hydroxy-2-methylpropyl)carbamoyl]amino]acetic acid
CID 79377748
2-cyclopropyl-2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetic acid
CID 82951883
2-[[ethyl(2-methoxyethyl)carbamoyl]amino]butanoic acid
CID 61447549
2-cyclohexyl-2-[[methyl(2-methylpropyl)carbamoyl]amino]acetic acid
CID 61195307
(2S)-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]-4-methoxy-4-oxobutanoic acid
CID 63305117
(2S)-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]-4-methylpentanoic acid
CID 54947939
2-[cycloheptylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79271342
(2R)-2-[bis(2-methoxyethyl)carbamoylamino]-3-hydroxypropanoic acid
CID 80755955
2-[[ethyl(2-methoxyethyl)carbamoyl]amino]-4-methylsulfanylbutanoic acid
CID 54948450
2-cyclohexyl-2-(propylcarbamoylamino)acetic acid
CID 61014378

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid?
The IUPAC name of 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid (CID 61447344) is 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid.
What is the SMILES notation for 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid?
The canonical SMILES for 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid is CCN(CCOC)C(=O)NC(C(=O)O)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid?
The InChIKey is LDFZEDJAWNAJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O4/c1-3-16(9-10-20-2)14(19)15-12(13(17)18)11-7-5-4-6-8-11/h11-12H,3-10H2,1-2H3,(H,15,19)(H,17,18).
What are the key properties of 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid?
2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid has a molecular weight of 286.37 g/mol, XLogP of 1.70, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-[[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid is sourced from PubChem (CID 61447344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).