N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide

Name: N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₈H₁₇N₃O₃ — CID 155074800

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACN-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide

SMILESCOc1cnc(C(=O)NC2CCc3cc(C#N)ccc32)c(OC)c1

InChIInChI=1S/C18H17N3O3/c1-23-13-8-16(24-2)17(20-10-13)18(22)21-15-6-4-12-7-11(9-19)3-5-14(12)15/h3,5,7-8,10,15H,4,6H2,1-2H3,(H,21,22)

InChIKeyMQMDZENACYAQFV-UHFFFAOYSA-N

MW323.35 g/mol

LogP2.39

Rot. Bonds4

About N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide

N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide (PubChem CID 155074800) has the molecular formula C₁₈H₁₇N₃O₃ and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide.

Molecular Properties

Compound Name	N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide
PubChem CID	155074800
Molecular Formula	C₁₈H₁₇N₃O₃
Molecular Weight	323.35 g/mol
Exact Mass	323.13
IUPAC Name	N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide
SMILES	COc1cnc(C(=O)NC2CCc3cc(C#N)ccc32)c(OC)c1
InChI	InChI=1S/C18H17N3O3/c1-23-13-8-16(24-2)17(20-10-13)18(22)21-15-6-4-12-7-11(9-19)3-5-14(12)15/h3,5,7-8,10,15H,4,6H2,1-2H3,(H,21,22)
InChIKey	MQMDZENACYAQFV-UHFFFAOYSA-N
XLogP	2.39
TPSA	84.24 Å²
H-Bond Donors	1
H-Bond Acceptors	5
Rotatable Bonds	4
Heavy Atoms	24
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	323.35
LogP ≤ 5	2.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide?

The IUPAC name of N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide (CID 155074800) is N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide.

What is the SMILES notation for N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide?

The canonical SMILES for N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide is COc1cnc(C(=O)NC2CCc3cc(C#N)ccc32)c(OC)c1.

What is the InChIKey of N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide?

The InChIKey is MQMDZENACYAQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-23-13-8-16(24-2)17(20-10-13)18(22)21-15-6-4-12-7-11(9-19)3-5-14(12)15/h3,5,7-8,10,15H,4,6H2,1-2H3,(H,21,22).

What are the key properties of N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide?

N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide has a molecular weight of 323.35 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-cyano-2,3-dihydro-1H-inden-1-yl)-3,5-dimethoxypyridine-2-carboxamide is sourced from PubChem (CID 155074800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 155074800 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.