2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine

C13H16N4 — CID 124980656

IUPAC2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
SMILESc1cn(-c2ccc(C[C@@H]3CCNC3)cn2)cn1
InChIInChI=1S/C13H16N4/c1-2-13(17-6-5-15-10-17)16-9-11(1)7-12-3-4-14-8-12/h1-2,5-6,9-10,12,14H,3-4,7-8H2/t12-/m0/s1
InChIKeyMKMMOANZWPIPLY-LBPRGKRZSA-N
MW228.30 g/mol
LogP1.42
Rot. Bonds3

About 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine

2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine (PubChem CID 124980656) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine.

Molecular Properties

Compound Name2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
PubChem CID124980656
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
SMILESc1cn(-c2ccc(C[C@@H]3CCNC3)cn2)cn1
InChIInChI=1S/C13H16N4/c1-2-13(17-6-5-15-10-17)16-9-11(1)7-12-3-4-14-8-12/h1-2,5-6,9-10,12,14H,3-4,7-8H2/t12-/m0/s1
InChIKeyMKMMOANZWPIPLY-LBPRGKRZSA-N
XLogP1.42
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine 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-(chloromethyl)-2-imidazol-1-ylpyridine;hydrochloride
CID 50988462
N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide
CID 63005414
N-(2-pyridin-4-ylethyl)-5-(pyrrolidin-3-ylmethyl)pyridin-2-amine
CID 110257850
2-cyclopentyl-N-[(6-imidazol-1-yl-3-pyridinyl)methyl]acetamide
CID 134040291
(5S)-3-[(6-imidazol-1-yl-3-pyridinyl)methyl]-5-methyl-2-sulfanylideneimidazolidin-4-one
CID 25341989
(3R)-3-[(4-fluorophenyl)methyl]pyrrolidine
CID 86309434
2-bromo-5-[[(3S)-piperidin-3-yl]methyl]pyridine
CID 130804072
2-(5-methyl-1H-pyrazol-3-yl)-5-(pyrrolidin-3-ylmethyl)pyridine
CID 110102053
3-[[4-(fluoromethyl)phenyl]methyl]pyrrolidine
CID 84665010
N-(6-imidazol-1-yl-3-pyridinyl)-2-morpholin-2-ylacetamide;dihydrochloride
CID 119846852
3-[(3,4-dichlorophenyl)methyl]pyrrolidine
CID 82158944
4-(pyrrolidin-3-ylmethyl)benzaldehyde
CID 105443694

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine?
The IUPAC name of 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine (CID 124980656) is 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine.
What is the SMILES notation for 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine?
The canonical SMILES for 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine is c1cn(-c2ccc(C[C@@H]3CCNC3)cn2)cn1.
What is the InChIKey of 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine?
The InChIKey is MKMMOANZWPIPLY-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H16N4/c1-2-13(17-6-5-15-10-17)16-9-11(1)7-12-3-4-14-8-12/h1-2,5-6,9-10,12,14H,3-4,7-8H2/t12-/m0/s1.
What are the key properties of 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine?
2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine has a molecular weight of 228.30 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine is sourced from PubChem (CID 124980656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).