2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid

C15H25NO4 — CID 103555560

IUPAC2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid
SMILESCOC1(CC(=O)NC(C(=O)O)C2CCCCC2)CCC1
InChIInChI=1S/C15H25NO4/c1-20-15(8-5-9-15)10-12(17)16-13(14(18)19)11-6-3-2-4-7-11/h11,13H,2-10H2,1H3,(H,16,17)(H,18,19)
InChIKeySVKYZQAAVCIECV-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.10
Rot. Bonds6

About 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid

2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid (PubChem CID 103555560) has the molecular formula C15H25NO4 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid
PubChem CID103555560
Molecular FormulaC15H25NO4
Molecular Weight283.37 g/mol
Exact Mass283.18
IUPAC Name2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid
SMILESCOC1(CC(=O)NC(C(=O)O)C2CCCCC2)CCC1
InChIInChI=1S/C15H25NO4/c1-20-15(8-5-9-15)10-12(17)16-13(14(18)19)11-6-3-2-4-7-11/h11,13H,2-10H2,1H3,(H,16,17)(H,18,19)
InChIKeySVKYZQAAVCIECV-UHFFFAOYSA-N
XLogP2.10
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(1-methoxycyclobutyl)acetyl]amino]-2-(oxan-3-yl)acetic acid
CID 120690223
(2R)-2-[[2-(1-methoxycyclobutyl)acetyl]amino]-3-methylbutanoic acid
CID 103555686
4-hydroxy-2-[[2-(1-methoxycyclobutyl)acetyl]amino]butanoic acid
CID 103555576
2-cyclohexyl-2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]acetic acid
CID 102656029
diethyl 2-[[2-(1-methoxycyclobutyl)acetyl]amino]propanedioate
CID 103519956
1-cyclohexyl-2-(1-methoxycyclobutyl)ethanone
CID 103558733
2-(1-methoxycyclobutyl)acetohydrazide
CID 103555801
2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid
CID 61159791
ethyl 2-[[2-(1-methoxycyclobutyl)acetyl]amino]propanoate
CID 103520334
3-[[2-(1-methoxycyclobutyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 103555615
N-(3-hydroxycyclobutyl)-2-(1-methoxycyclobutyl)acetamide
CID 103557188
2-[[2-(1-methoxycyclobutyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 103555673

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid?
The IUPAC name of 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid (CID 103555560) is 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid.
What is the SMILES notation for 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid?
The canonical SMILES for 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid is COC1(CC(=O)NC(C(=O)O)C2CCCCC2)CCC1.
What is the InChIKey of 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid?
The InChIKey is SVKYZQAAVCIECV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c1-20-15(8-5-9-15)10-12(17)16-13(14(18)19)11-6-3-2-4-7-11/h11,13H,2-10H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid?
2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid has a molecular weight of 283.37 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid is sourced from PubChem (CID 103555560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).