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

C16H16N2O — CID 42941210

IUPACN-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide
SMILESCN(C(=O)c1ccccn1)C1CCc2ccccc21
InChIInChI=1S/C16H16N2O/c1-18(16(19)14-8-4-5-11-17-14)15-10-9-12-6-2-3-7-13(12)15/h2-8,11,15H,9-10H2,1H3
InChIKeyDOVYVTBKHCYLIH-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.84
Rot. Bonds2

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

N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide (PubChem CID 42941210) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide
PubChem CID42941210
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide
SMILESCN(C(=O)c1ccccn1)C1CCc2ccccc21
InChIInChI=1S/C16H16N2O/c1-18(16(19)14-8-4-5-11-17-14)15-10-9-12-6-2-3-7-13(12)15/h2-8,11,15H,9-10H2,1H3
InChIKeyDOVYVTBKHCYLIH-UHFFFAOYSA-N
XLogP2.84
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.84
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-methylpyridine-2-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide (CID 42941210) is N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide is CN(C(=O)c1ccccn1)C1CCc2ccccc21.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide?
The InChIKey is DOVYVTBKHCYLIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-18(16(19)14-8-4-5-11-17-14)15-10-9-12-6-2-3-7-13(12)15/h2-8,11,15H,9-10H2,1H3.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide?
N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyridine-2-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 2.84, 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-methylpyridine-2-carboxamide is sourced from PubChem (CID 42941210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).