(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide

C10H20N2O2 — CID 59254540

IUPAC(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide
SMILESCC(C)[C@@H](N)C(=O)NCC1CCCO1
InChIInChI=1S/C10H20N2O2/c1-7(2)9(11)10(13)12-6-8-4-3-5-14-8/h7-9H,3-6,11H2,1-2H3,(H,12,13)/t8?,9-/m1/s1
InChIKeyAIZHBXNJALYINJ-YGPZHTELSA-N
MW200.28 g/mol
LogP0.26
Rot. Bonds4

About (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide

(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide (PubChem CID 59254540) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide
PubChem CID59254540
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide
SMILESCC(C)[C@@H](N)C(=O)NCC1CCCO1
InChIInChI=1S/C10H20N2O2/c1-7(2)9(11)10(13)12-6-8-4-3-5-14-8/h7-9H,3-6,11H2,1-2H3,(H,12,13)/t8?,9-/m1/s1
InChIKeyAIZHBXNJALYINJ-YGPZHTELSA-N
XLogP0.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide?
The IUPAC name of (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide (CID 59254540) is (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide.
What is the SMILES notation for (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide?
The canonical SMILES for (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide is CC(C)[C@@H](N)C(=O)NCC1CCCO1.
What is the InChIKey of (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide?
The InChIKey is AIZHBXNJALYINJ-YGPZHTELSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)9(11)10(13)12-6-8-4-3-5-14-8/h7-9H,3-6,11H2,1-2H3,(H,12,13)/t8?,9-/m1/s1.
What are the key properties of (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide?
(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide has a molecular weight of 200.28 g/mol, XLogP of 0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide is sourced from PubChem (CID 59254540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).