N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide

C17H18N2O — CID 42944559

IUPACN-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(C)C2CCc3ccccc32)n1
InChIInChI=1S/C17H18N2O/c1-12-6-5-9-15(18-12)17(20)19(2)16-11-10-13-7-3-4-8-14(13)16/h3-9,16H,10-11H2,1-2H3
InChIKeyOYTLQEXFECEZRI-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.15
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide

N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide (PubChem CID 42944559) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide
PubChem CID42944559
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(C)C2CCc3ccccc32)n1
InChIInChI=1S/C17H18N2O/c1-12-6-5-9-15(18-12)17(20)19(2)16-11-10-13-7-3-4-8-14(13)16/h3-9,16H,10-11H2,1-2H3
InChIKeyOYTLQEXFECEZRI-UHFFFAOYSA-N
XLogP3.15
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide (CID 42944559) is N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide is Cc1cccc(C(=O)N(C)C2CCc3ccccc32)n1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide?
The InChIKey is OYTLQEXFECEZRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-12-6-5-9-15(18-12)17(20)19(2)16-11-10-13-7-3-4-8-14(13)16/h3-9,16H,10-11H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide?
N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 42944559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).