2-[cyclohexanecarbonyl(methyl)amino]acetic acid

C10H17NO3 — CID 16773468

IUPAC2-[cyclohexanecarbonyl(methyl)amino]acetic acid
SMILESCN(CC(=O)O)C(=O)C1CCCCC1
InChIInChI=1S/C10H17NO3/c1-11(7-9(12)13)10(14)8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H,12,13)
InChIKeySLZWLHCXGUWSJX-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.11
Rot. Bonds3

About 2-[cyclohexanecarbonyl(methyl)amino]acetic acid

2-[cyclohexanecarbonyl(methyl)amino]acetic acid (PubChem CID 16773468) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-[cyclohexanecarbonyl(methyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclohexanecarbonyl(methyl)amino]acetic acid
PubChem CID16773468
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name2-[cyclohexanecarbonyl(methyl)amino]acetic acid
SMILESCN(CC(=O)O)C(=O)C1CCCCC1
InChIInChI=1S/C10H17NO3/c1-11(7-9(12)13)10(14)8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H,12,13)
InChIKeySLZWLHCXGUWSJX-UHFFFAOYSA-N
XLogP1.11
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexanecarbonyl(methyl)amino]acetic acid?
The IUPAC name of 2-[cyclohexanecarbonyl(methyl)amino]acetic acid (CID 16773468) is 2-[cyclohexanecarbonyl(methyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclohexanecarbonyl(methyl)amino]acetic acid?
The canonical SMILES for 2-[cyclohexanecarbonyl(methyl)amino]acetic acid is CN(CC(=O)O)C(=O)C1CCCCC1.
What is the InChIKey of 2-[cyclohexanecarbonyl(methyl)amino]acetic acid?
The InChIKey is SLZWLHCXGUWSJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-11(7-9(12)13)10(14)8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H,12,13).
What are the key properties of 2-[cyclohexanecarbonyl(methyl)amino]acetic acid?
2-[cyclohexanecarbonyl(methyl)amino]acetic acid has a molecular weight of 199.25 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexanecarbonyl(methyl)amino]acetic acid is sourced from PubChem (CID 16773468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).