4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine

C11H11N5 — CID 138500278

IUPAC4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCCn1cc(-c2ccnc3[nH]ccc23)nn1
InChIInChI=1S/C11H11N5/c1-2-16-7-10(14-15-16)8-3-5-12-11-9(8)4-6-13-11/h3-7H,2H2,1H3,(H,12,13)
InChIKeyZSZQVQMTHDDMRZ-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.84
Rot. Bonds2

About 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine

4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 138500278) has the molecular formula C11H11N5 and a molecular weight of 213.24 g/mol. Its IUPAC name is 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID138500278
Molecular FormulaC11H11N5
Molecular Weight213.24 g/mol
Exact Mass213.10
IUPAC Name4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCCn1cc(-c2ccnc3[nH]ccc23)nn1
InChIInChI=1S/C11H11N5/c1-2-16-7-10(14-15-16)8-3-5-12-11-9(8)4-6-13-11/h3-7H,2H2,1H3,(H,12,13)
InChIKeyZSZQVQMTHDDMRZ-UHFFFAOYSA-N
XLogP1.84
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 151444691
4-(1-propylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 90697312
4-[1-(trifluoromethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 166375892
4-(4-methylphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 57482994
4-(6-methyl-2-propylpyrimidin-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 70774610
4-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 66827127
4-(1-ethyltriazol-4-yl)pyrimidin-2-amine
CID 137487091
1-[4-[1-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-3-yl]phenyl]-3-pyridin-4-ylurea
CID 58980040
N-(2-methylpropyl)-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrimidin-2-amine
CID 167817845
4-[1-[(3,5-dimethoxyphenyl)methyl]pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 57477711
4-(6-fluoro-2-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
CID 11999615
6-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyridine-3-carboxamide
CID 164603219

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine (CID 138500278) is 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine is CCn1cc(-c2ccnc3[nH]ccc23)nn1.
What is the InChIKey of 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is ZSZQVQMTHDDMRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5/c1-2-16-7-10(14-15-16)8-3-5-12-11-9(8)4-6-13-11/h3-7H,2H2,1H3,(H,12,13).
What are the key properties of 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 213.24 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyltriazol-4-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 138500278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).