(3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one

C9H18N2O3 — CID 69153085

IUPAC(3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one
SMILESCO[C@H](C)C(N)C(=O)N1CCOCC1
InChIInChI=1S/C9H18N2O3/c1-7(13-2)8(10)9(12)11-3-5-14-6-4-11/h7-8H,3-6,10H2,1-2H3/t7-,8?/m1/s1
InChIKeyRRBLNFOYTWHGJD-GVHYBUMESA-N
MW202.25 g/mol
LogP-0.79
Rot. Bonds3

About (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one

(3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one (PubChem CID 69153085) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name(3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one
PubChem CID69153085
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name(3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one
SMILESCO[C@H](C)C(N)C(=O)N1CCOCC1
InChIInChI=1S/C9H18N2O3/c1-7(13-2)8(10)9(12)11-3-5-14-6-4-11/h7-8H,3-6,10H2,1-2H3/t7-,8?/m1/s1
InChIKeyRRBLNFOYTWHGJD-GVHYBUMESA-N
XLogP-0.79
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one?
The IUPAC name of (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one (CID 69153085) is (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one is CO[C@H](C)C(N)C(=O)N1CCOCC1.
What is the InChIKey of (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one?
The InChIKey is RRBLNFOYTWHGJD-GVHYBUMESA-N. The full InChI is InChI=1S/C9H18N2O3/c1-7(13-2)8(10)9(12)11-3-5-14-6-4-11/h7-8H,3-6,10H2,1-2H3/t7-,8?/m1/s1.
What are the key properties of (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one?
(3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one has a molecular weight of 202.25 g/mol, XLogP of -0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-amino-3-methoxy-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 69153085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).