1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole

C14H17N3O — CID 104941589

IUPAC1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
SMILESCOc1ccccc1-n1cncc1[C@@H]1CCCN1
InChIInChI=1S/C14H17N3O/c1-18-14-7-3-2-6-12(14)17-10-15-9-13(17)11-5-4-8-16-11/h2-3,6-7,9-11,16H,4-5,8H2,1H3/t11-/m0/s1
InChIKeyKYHIWFAZZFLVJX-NSHDSACASA-N
MW243.31 g/mol
LogP2.31
Rot. Bonds3

About 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole

1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole (PubChem CID 104941589) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
PubChem CID104941589
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
SMILESCOc1ccccc1-n1cncc1[C@@H]1CCCN1
InChIInChI=1S/C14H17N3O/c1-18-14-7-3-2-6-12(14)17-10-15-9-13(17)11-5-4-8-16-11/h2-3,6-7,9-11,16H,4-5,8H2,1H3/t11-/m0/s1
InChIKeyKYHIWFAZZFLVJX-NSHDSACASA-N
XLogP2.31
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole 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

1-(2-methylphenyl)-5-pyrrolidin-2-ylimidazole
CID 114703790
1-phenyl-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942009
N,N-dimethyl-2-(5-piperidin-2-ylimidazol-1-yl)aniline
CID 106761198
1-(2-chloro-5-methoxyphenyl)-5-pyrrolidin-2-ylimidazole
CID 114704542
2-[3-(3-bromo-4-methoxyphenyl)imidazol-4-yl]piperidine
CID 114706296
2-methoxy-5-(5-piperidin-2-ylimidazol-1-yl)pyridine
CID 114702661
2-[3-(4-methoxy-2-methylphenyl)imidazol-4-yl]piperidine
CID 114705681
3-(5-pyrrolidin-2-ylimidazol-1-yl)pyridine
CID 114703701
5-methoxy-1-methyl-3-[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]pyrazole
CID 114256723
4-[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]pyridine
CID 104942033
(2R)-2-(2-methoxyphenyl)pyrrolidine
CID 7047810
1-(2-fluoro-4-methylphenyl)-5-pyrrolidin-2-ylimidazole
CID 114703942

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole?
The IUPAC name of 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole (CID 104941589) is 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole.
What is the SMILES notation for 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole?
The canonical SMILES for 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole is COc1ccccc1-n1cncc1[C@@H]1CCCN1.
What is the InChIKey of 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole?
The InChIKey is KYHIWFAZZFLVJX-NSHDSACASA-N. The full InChI is InChI=1S/C14H17N3O/c1-18-14-7-3-2-6-12(14)17-10-15-9-13(17)11-5-4-8-16-11/h2-3,6-7,9-11,16H,4-5,8H2,1H3/t11-/m0/s1.
What are the key properties of 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole?
1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole has a molecular weight of 243.31 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-5-[(2S)-pyrrolidin-2-yl]imidazole is sourced from PubChem (CID 104941589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).