(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide

C9H18N2O2 — CID 134516134

IUPAC(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide
SMILESCO[C@@H]([C@@H]1CCCN1)[C@@H](C)C(N)=O
InChIInChI=1S/C9H18N2O2/c1-6(9(10)12)8(13-2)7-4-3-5-11-7/h6-8,11H,3-5H2,1-2H3,(H2,10,12)/t6-,7+,8-/m1/s1
InChIKeyYLYDSZXUQRIUIR-GJMOJQLCSA-N
MW186.25 g/mol
LogP-0.13
Rot. Bonds4

About (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide

(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide (PubChem CID 134516134) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide.

Molecular Properties

Compound Name(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide
PubChem CID134516134
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide
SMILESCO[C@@H]([C@@H]1CCCN1)[C@@H](C)C(N)=O
InChIInChI=1S/C9H18N2O2/c1-6(9(10)12)8(13-2)7-4-3-5-11-7/h6-8,11H,3-5H2,1-2H3,(H2,10,12)/t6-,7+,8-/m1/s1
InChIKeyYLYDSZXUQRIUIR-GJMOJQLCSA-N
XLogP-0.13
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoate
CID 118577691
3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoic acid
CID 118577568
(2R,3S)-3-methoxy-2-methyl-3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride
CID 138958295
(2S,3R)-N-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide
CID 169449920
(3R,4R)-1-benzylsulfonyl-4-methoxy-3-methyl-4-[(2S)-pyrrolidin-2-yl]butan-2-one
CID 147728581
2-pyrrolidin-2-ylbutanamide
CID 69095576
ethyl (2R,3S)-3-hydroxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoate
CID 101351583
(2R,3R)-N-[(E,2R,3S)-4-ethenyl-3-hydroxyhept-4-en-2-yl]-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide
CID 145321333
(3R,4R)-4-methoxy-3-methyl-4-[(2S)-pyrrolidin-2-yl]-1-quinolin-2-ylbutan-2-one
CID 157271194
(2R,3R)-3-methoxy-2-methyl-3-pyrrolidin-2-yl-N-quinolin-2-ylpropanamide
CID 70810642
ethyl 2-pyrrolidin-2-ylpropanoate
CID 12896133
(2S)-2-(dimethoxymethyl)pyrrolidine
CID 11658393

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide?
The IUPAC name of (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide (CID 134516134) is (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide.
What is the SMILES notation for (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide?
The canonical SMILES for (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide is CO[C@@H]([C@@H]1CCCN1)[C@@H](C)C(N)=O.
What is the InChIKey of (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide?
The InChIKey is YLYDSZXUQRIUIR-GJMOJQLCSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-6(9(10)12)8(13-2)7-4-3-5-11-7/h6-8,11H,3-5H2,1-2H3,(H2,10,12)/t6-,7+,8-/m1/s1.
What are the key properties of (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide?
(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide has a molecular weight of 186.25 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide is sourced from PubChem (CID 134516134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).