2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine

C17H18N6 — CID 124992481

IUPAC2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine
SMILESc1cncc(CN2CCC[C@@H]2c2cnc(-c3ncc[nH]3)cn2)c1
InChIInChI=1S/C17H18N6/c1-3-13(9-18-5-1)12-23-8-2-4-16(23)14-10-22-15(11-21-14)17-19-6-7-20-17/h1,3,5-7,9-11,16H,2,4,8,12H2,(H,19,20)/t16-/m1/s1
InChIKeyPQZFKMJDIGPHEP-MRXNPFEDSA-N
MW306.37 g/mol
LogP2.60
Rot. Bonds4

About 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine

2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine (PubChem CID 124992481) has the molecular formula C17H18N6 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine
PubChem CID124992481
Molecular FormulaC17H18N6
Molecular Weight306.37 g/mol
Exact Mass306.16
IUPAC Name2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine
SMILESc1cncc(CN2CCC[C@@H]2c2cnc(-c3ncc[nH]3)cn2)c1
InChIInChI=1S/C17H18N6/c1-3-13(9-18-5-1)12-23-8-2-4-16(23)14-10-22-15(11-21-14)17-19-6-7-20-17/h1,3,5-7,9-11,16H,2,4,8,12H2,(H,19,20)/t16-/m1/s1
InChIKeyPQZFKMJDIGPHEP-MRXNPFEDSA-N
XLogP2.60
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1H-imidazol-2-yl)-2-methyl-6-[1-(pyridin-3-ylmethyl)piperidin-2-yl]pyrimidine
CID 110099535
2-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95841459
3-[[(2S)-2-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine
CID 124992533
2-[(4-methylphenyl)methyl]-6-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95817914
2-(2-ethylimidazol-1-yl)-6-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine
CID 95838557
2-[2-[5-(1H-imidazol-2-yl)pyrazin-2-yl]pyrrolidin-1-yl]-4,6-dimethoxy-1,3,5-triazine
CID 110091071
2-[1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]pyrazine
CID 73440222
2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-6-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrimidin-4-amine
CID 110256090
2-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]-4,5,6,7-tetrahydro-1H-benzimidazole
CID 129339719
5-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]imidazo[1,2-a]pyridine
CID 110100075
N-pyridin-2-yl-4-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrimidin-2-amine
CID 95837564
2-imidazol-1-yl-6-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine
CID 95838554

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine?
The IUPAC name of 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine (CID 124992481) is 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine?
The canonical SMILES for 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine is c1cncc(CN2CCC[C@@H]2c2cnc(-c3ncc[nH]3)cn2)c1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine?
The InChIKey is PQZFKMJDIGPHEP-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H18N6/c1-3-13(9-18-5-1)12-23-8-2-4-16(23)14-10-22-15(11-21-14)17-19-6-7-20-17/h1,3,5-7,9-11,16H,2,4,8,12H2,(H,19,20)/t16-/m1/s1.
What are the key properties of 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine?
2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine has a molecular weight of 306.37 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-5-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine is sourced from PubChem (CID 124992481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).