4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid

C11H15N3O4 — CID 74241862

IUPAC4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid
SMILESCOC[C@H]1CCCN1C(=O)c1nc[nH]c1C(=O)O
InChIInChI=1S/C11H15N3O4/c1-18-5-7-3-2-4-14(7)10(15)8-9(11(16)17)13-6-12-8/h6-7H,2-5H2,1H3,(H,12,13)(H,16,17)/t7-/m1/s1
InChIKeyZWXDIAUHPMWAAP-SSDOTTSWSA-N
MW253.26 g/mol
LogP0.36
Rot. Bonds4

About 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid

4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid (PubChem CID 74241862) has the molecular formula C11H15N3O4 and a molecular weight of 253.26 g/mol. Its IUPAC name is 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid.

Molecular Properties

Compound Name4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid
PubChem CID74241862
Molecular FormulaC11H15N3O4
Molecular Weight253.26 g/mol
Exact Mass253.11
IUPAC Name4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid
SMILESCOC[C@H]1CCCN1C(=O)c1nc[nH]c1C(=O)O
InChIInChI=1S/C11H15N3O4/c1-18-5-7-3-2-4-14(7)10(15)8-9(11(16)17)13-6-12-8/h6-7H,2-5H2,1H3,(H,12,13)(H,16,17)/t7-/m1/s1
InChIKeyZWXDIAUHPMWAAP-SSDOTTSWSA-N
XLogP0.36
TPSA95.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thiophene-2-carboxylic acid
CID 58714770
6-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one
CID 74238277
[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-(1,3-thiazol-4-yl)methanone
CID 141115735
3-[2-(methoxymethyl)pyrrolidine-1-carbonyl]-2-methylbenzoic acid
CID 167888085
3-[(2S)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-5-methylbenzoic acid
CID 141091395
(3,4-dichlorophenyl)-[2-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 110866902
3-[(2S)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-5-methylbenzoic acid;hydrochloride
CID 141091394
ethane;1-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanone
CID 143652915
[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-[4-(2-methyltetrazol-5-yl)phenyl]methanone
CID 77089273
[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-(4-pyrimidin-5-ylphenyl)methanone
CID 118775706
4-[(2S)-2-(methoxymethyl)piperidin-1-yl]-4-oxobutanoic acid
CID 129359557
(5-methoxy-3-methyl-1H-indol-2-yl)-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 74238881

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid?
The IUPAC name of 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid (CID 74241862) is 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid.
What is the SMILES notation for 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid?
The canonical SMILES for 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid is COC[C@H]1CCCN1C(=O)c1nc[nH]c1C(=O)O.
What is the InChIKey of 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid?
The InChIKey is ZWXDIAUHPMWAAP-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H15N3O4/c1-18-5-7-3-2-4-14(7)10(15)8-9(11(16)17)13-6-12-8/h6-7H,2-5H2,1H3,(H,12,13)(H,16,17)/t7-/m1/s1.
What are the key properties of 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid?
4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]-1H-imidazole-5-carboxylic acid is sourced from PubChem (CID 74241862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).