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

C13H17N3O — CID 104942485

IUPAC1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole
SMILESc1coc(CCn2cncc2[C@@H]2CCCN2)c1
InChIInChI=1S/C13H17N3O/c1-4-12(15-6-1)13-9-14-10-16(13)7-5-11-3-2-8-17-11/h2-3,8-10,12,15H,1,4-7H2/t12-/m0/s1
InChIKeyZVZRGZJIMOCGAK-LBPRGKRZSA-N
MW231.30 g/mol
LogP2.14
Rot. Bonds4

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

1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole (PubChem CID 104942485) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole.

Molecular Properties

Compound Name1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole
PubChem CID104942485
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole
SMILESc1coc(CCn2cncc2[C@@H]2CCCN2)c1
InChIInChI=1S/C13H17N3O/c1-4-12(15-6-1)13-9-14-10-16(13)7-5-11-3-2-8-17-11/h2-3,8-10,12,15H,1,4-7H2/t12-/m0/s1
InChIKeyZVZRGZJIMOCGAK-LBPRGKRZSA-N
XLogP2.14
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(furan-2-yl)ethyl]-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-[4-(furan-2-yl)butan-2-yl]-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942681
2-[3-[2-(2-methylphenyl)ethyl]imidazol-4-yl]piperidine
CID 114706613
5-[(5-pyrrolidin-2-ylimidazol-1-yl)methyl]-1,2-oxazole
CID 106422518
5-[[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]methyl]-1,2-oxazole
CID 106422527
1-[2-(4-methoxyphenyl)ethyl]-5-pyrrolidin-2-ylimidazole
CID 114702887
1-(2-methylsulfonylethyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942355
4-(furan-2-ylmethyl)-3-pyrrolidin-2-yl-1,2,4-triazole
CID 82472110
1-(naphthalen-1-ylmethyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942995
1-ethyl-5-pyrrolidin-2-ylimidazole
CID 66134082
4-[[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]methyl]pyridine
CID 104942141
5-pyrrolidin-2-yl-1-(2,2,3,3-tetrafluoropropyl)imidazole
CID 106291736
1-[2-(4-fluoro-2-methylphenyl)ethyl]-5-pyrrolidin-2-ylimidazole
CID 114706692

Frequently Asked Questions

What is the IUPAC name of 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole?
The IUPAC name of 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole (CID 104942485) is 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole.
What is the SMILES notation for 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole?
The canonical SMILES for 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole is c1coc(CCn2cncc2[C@@H]2CCCN2)c1.
What is the InChIKey of 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole?
The InChIKey is ZVZRGZJIMOCGAK-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H17N3O/c1-4-12(15-6-1)13-9-14-10-16(13)7-5-11-3-2-8-17-11/h2-3,8-10,12,15H,1,4-7H2/t12-/m0/s1.
What are the key properties of 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole?
1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole has a molecular weight of 231.30 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(furan-2-yl)ethyl]-5-[(2S)-pyrrolidin-2-yl]imidazole is sourced from PubChem (CID 104942485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).