1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine

C14H10N6 — CID 118577194

IUPAC1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine
SMILESc1cc2ccn(-c3ncc(-c4ccn[nH]4)cn3)c2cn1
InChIInChI=1S/C14H10N6/c1-4-15-9-13-10(1)3-6-20(13)14-16-7-11(8-17-14)12-2-5-18-19-12/h1-9H,(H,18,19)
InChIKeyCOAOLJXUFOYEFV-UHFFFAOYSA-N
MW262.28 g/mol
LogP2.21
Rot. Bonds2

About 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine

1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine (PubChem CID 118577194) has the molecular formula C14H10N6 and a molecular weight of 262.28 g/mol. Its IUPAC name is 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine
PubChem CID118577194
Molecular FormulaC14H10N6
Molecular Weight262.28 g/mol
Exact Mass262.10
IUPAC Name1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine
SMILESc1cc2ccn(-c3ncc(-c4ccn[nH]4)cn3)c2cn1
InChIInChI=1S/C14H10N6/c1-4-15-9-13-10(1)3-6-20(13)14-16-7-11(8-17-14)12-2-5-18-19-12/h1-9H,(H,18,19)
InChIKeyCOAOLJXUFOYEFV-UHFFFAOYSA-N
XLogP2.21
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methyltetrazol-5-yl)pyrrolo[2,3-c]pyridine;hydrochloride
CID 162492559
4-pyrrolo[2,3-c]pyridin-1-ylpyrimidin-2-amine
CID 71580743
1-oxidopyrrolo[2,3-c]pyridine
CID 87757695
5-bromo-2-pyrrolo[2,3-c]pyridin-1-yl-1H-pyridin-4-one
CID 118576979
1-fluoro-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine
CID 118577050
1-[5-[(E)-2-pyridin-4-ylethenyl]-2-pyridinyl]pyrrolo[2,3-c]pyridine
CID 118585650
[4-(6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)-2-pyridinyl] thiohypofluorite
CID 144977079
2-propan-2-yl-5-(1H-pyrazol-5-yl)pyrimidine
CID 170448703
1-pyrazin-2-ylindole
CID 58898193
tributyl-(6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)stannane
CID 140783416
5-(1H-pyrazol-5-yl)triazine
CID 173069530
8-methyl-3-pyrrolo[2,3-c]pyridin-1-ylisoquinolin-5-amine
CID 144977078

Frequently Asked Questions

What is the IUPAC name of 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine?
The IUPAC name of 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine (CID 118577194) is 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine?
The canonical SMILES for 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine is c1cc2ccn(-c3ncc(-c4ccn[nH]4)cn3)c2cn1.
What is the InChIKey of 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine?
The InChIKey is COAOLJXUFOYEFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6/c1-4-15-9-13-10(1)3-6-20(13)14-16-7-11(8-17-14)12-2-5-18-19-12/h1-9H,(H,18,19).
What are the key properties of 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine?
1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine has a molecular weight of 262.28 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1H-pyrazol-5-yl)pyrimidin-2-yl]pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 118577194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).