(2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid

C10H19NO2 — CID 172766899

IUPAC(2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid
SMILESCC1CCCCC1[C@@](C)(N)C(=O)O
InChIInChI=1S/C10H19NO2/c1-7-5-3-4-6-8(7)10(2,11)9(12)13/h7-8H,3-6,11H2,1-2H3,(H,12,13)/t7?,8?,10-/m1/s1
InChIKeyMKWMTEPCSQOLLQ-SFVIPPHHSA-N
MW185.27 g/mol
LogP1.61
Rot. Bonds2

About (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid

(2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid (PubChem CID 172766899) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid
PubChem CID172766899
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid
SMILESCC1CCCCC1[C@@](C)(N)C(=O)O
InChIInChI=1S/C10H19NO2/c1-7-5-3-4-6-8(7)10(2,11)9(12)13/h7-8H,3-6,11H2,1-2H3,(H,12,13)/t7?,8?,10-/m1/s1
InChIKeyMKWMTEPCSQOLLQ-SFVIPPHHSA-N
XLogP1.61
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid?
The IUPAC name of (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid (CID 172766899) is (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid.
What is the SMILES notation for (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid?
The canonical SMILES for (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid is CC1CCCCC1[C@@](C)(N)C(=O)O.
What is the InChIKey of (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid?
The InChIKey is MKWMTEPCSQOLLQ-SFVIPPHHSA-N. The full InChI is InChI=1S/C10H19NO2/c1-7-5-3-4-6-8(7)10(2,11)9(12)13/h7-8H,3-6,11H2,1-2H3,(H,12,13)/t7?,8?,10-/m1/s1.
What are the key properties of (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid?
(2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid has a molecular weight of 185.27 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(2-methylcyclohexyl)propanoic acid is sourced from PubChem (CID 172766899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).