N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide

C17H15N5O2 — CID 170235948

IUPACN-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide
SMILESCOc1c(-c2cc3cc(NC=O)ncc3n2C)ccc2cn[nH]c12
InChIInChI=1S/C17H15N5O2/c1-22-13(5-11-6-15(19-9-23)18-8-14(11)22)12-4-3-10-7-20-21-16(10)17(12)24-2/h3-9H,1-2H3,(H,20,21)(H,18,19,23)
InChIKeyAAZMFMPQXBHCAO-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.69
Rot. Bonds4

About N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide

N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide (PubChem CID 170235948) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide.

Molecular Properties

Compound NameN-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide
PubChem CID170235948
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC NameN-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide
SMILESCOc1c(-c2cc3cc(NC=O)ncc3n2C)ccc2cn[nH]c12
InChIInChI=1S/C17H15N5O2/c1-22-13(5-11-6-15(19-9-23)18-8-14(11)22)12-4-3-10-7-20-21-16(10)17(12)24-2/h3-9H,1-2H3,(H,20,21)(H,18,19,23)
InChIKeyAAZMFMPQXBHCAO-UHFFFAOYSA-N
XLogP2.69
TPSA84.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide?
The IUPAC name of N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide (CID 170235948) is N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide.
What is the SMILES notation for N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide?
The canonical SMILES for N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide is COc1c(-c2cc3cc(NC=O)ncc3n2C)ccc2cn[nH]c12.
What is the InChIKey of N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide?
The InChIKey is AAZMFMPQXBHCAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-22-13(5-11-6-15(19-9-23)18-8-14(11)22)12-4-3-10-7-20-21-16(10)17(12)24-2/h3-9H,1-2H3,(H,20,21)(H,18,19,23).
What are the key properties of N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide?
N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide has a molecular weight of 321.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methoxy-1H-indazol-6-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]formamide is sourced from PubChem (CID 170235948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).