(2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid

C7H15NO3 — CID 131230204

IUPAC(2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid
SMILESCO[C@H](C(C)C)[C@@H](N)C(=O)O
InChIInChI=1S/C7H15NO3/c1-4(2)6(11-3)5(8)7(9)10/h4-6H,8H2,1-3H3,(H,9,10)/t5-,6-/m1/s1
InChIKeyRQIFEKQYPCBUNV-PHDIDXHHSA-N
MW161.20 g/mol
LogP0.07
Rot. Bonds4

About (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid

(2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid (PubChem CID 131230204) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid.

Molecular Properties

Compound Name(2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid
PubChem CID131230204
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name(2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid
SMILESCO[C@H](C(C)C)[C@@H](N)C(=O)O
InChIInChI=1S/C7H15NO3/c1-4(2)6(11-3)5(8)7(9)10/h4-6H,8H2,1-3H3,(H,9,10)/t5-,6-/m1/s1
InChIKeyRQIFEKQYPCBUNV-PHDIDXHHSA-N
XLogP0.07
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid?
The IUPAC name of (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid (CID 131230204) is (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid.
What is the SMILES notation for (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid?
The canonical SMILES for (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid is CO[C@H](C(C)C)[C@@H](N)C(=O)O.
What is the InChIKey of (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid?
The InChIKey is RQIFEKQYPCBUNV-PHDIDXHHSA-N. The full InChI is InChI=1S/C7H15NO3/c1-4(2)6(11-3)5(8)7(9)10/h4-6H,8H2,1-3H3,(H,9,10)/t5-,6-/m1/s1.
What are the key properties of (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid?
(2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid has a molecular weight of 161.20 g/mol, XLogP of 0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-amino-3-methoxy-4-methylpentanoic acid is sourced from PubChem (CID 131230204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).