(3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid

C6H11NO3 — CID 18660153

IUPAC(3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid
SMILESCC1NC[C@@H](C(=O)O)C1O
InChIInChI=1S/C6H11NO3/c1-3-5(8)4(2-7-3)6(9)10/h3-5,7-8H,2H2,1H3,(H,9,10)/t3?,4-,5?/m1/s1
InChIKeyYAEWGMVTQRCMDK-ACHVEOLNSA-N
MW145.16 g/mol
LogP-0.96
Rot. Bonds1

About (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid

(3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid (PubChem CID 18660153) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid
PubChem CID18660153
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name(3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid
SMILESCC1NC[C@@H](C(=O)O)C1O
InChIInChI=1S/C6H11NO3/c1-3-5(8)4(2-7-3)6(9)10/h3-5,7-8H,2H2,1H3,(H,9,10)/t3?,4-,5?/m1/s1
InChIKeyYAEWGMVTQRCMDK-ACHVEOLNSA-N
XLogP-0.96
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R)-2-methylazetidine-3-carboxylic acid
CID 124580692
2-methylazetidine-3-carboxylic acid
CID 21293290
(2S,3R,4S,5S)-2-methylpiperidine-3,4,5-triol
CID 55300795
(2R,3R,4S,5S)-2-methylpiperidine-3,4,5-triol
CID 10888061
2-methyl-5-propan-2-ylpiperidine-3-carboxylic acid
CID 83915224
methyl 2-methylazetidine-3-carboxylate;hydrochloride
CID 118796246
(3R,5S,6S)-5,6-dimethylpiperidine-3-carboxylic acid
CID 178194412
(3S)-5-amino-2-methylpiperidine-3,4-diol
CID 59928049
(2R,3R)-2-methylpyrrolidine-3-carboxylic acid
CID 10887930
(2S,3S,4R,5R)-3,5-dihydroxy-4-methylpiperidine-2-carboxylic acid
CID 163596404
(2R,3S)-2-methylazetidin-3-ol;hydrochloride
CID 134691791
(2S,4S,5R)-piperidine-2,4,5-tricarboxylic acid
CID 10822635

Frequently Asked Questions

What is the IUPAC name of (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid?
The IUPAC name of (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid (CID 18660153) is (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid.
What is the SMILES notation for (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid?
The canonical SMILES for (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid is CC1NC[C@@H](C(=O)O)C1O.
What is the InChIKey of (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid?
The InChIKey is YAEWGMVTQRCMDK-ACHVEOLNSA-N. The full InChI is InChI=1S/C6H11NO3/c1-3-5(8)4(2-7-3)6(9)10/h3-5,7-8H,2H2,1H3,(H,9,10)/t3?,4-,5?/m1/s1.
What are the key properties of (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid?
(3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid has a molecular weight of 145.16 g/mol, XLogP of -0.96, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4-hydroxy-5-methylpyrrolidine-3-carboxylic acid is sourced from PubChem (CID 18660153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).