N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide

C18H16N2O — CID 106737122

IUPACN-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide
SMILESCN(C(=O)C1Cc2ccccc2C1)c1ccc(C#N)cc1
InChIInChI=1S/C18H16N2O/c1-20(17-8-6-13(12-19)7-9-17)18(21)16-10-14-4-2-3-5-15(14)11-16/h2-9,16H,10-11H2,1H3
InChIKeyRBTZPFSGLZYQMG-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.94
Rot. Bonds2

About N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide

N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106737122) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106737122
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC NameN-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide
SMILESCN(C(=O)C1Cc2ccccc2C1)c1ccc(C#N)cc1
InChIInChI=1S/C18H16N2O/c1-20(17-8-6-13(12-19)7-9-17)18(21)16-10-14-4-2-3-5-15(14)11-16/h2-9,16H,10-11H2,1H3
InChIKeyRBTZPFSGLZYQMG-UHFFFAOYSA-N
XLogP2.94
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-hydroxyphenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide
CID 106704324
N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76979846
1-amino-N-(4-cyanophenyl)-N-methylcyclopropane-1-carboxamide
CID 65464094
N-(4-cyanophenyl)-N,2-dimethylbenzamide
CID 62982757
6-chloro-N-(4-cyanophenyl)-N-methylpyridine-2-carboxamide
CID 62981263
N-(1-cyanopropan-2-yl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide
CID 106703438
N-(4-cyanophenyl)-N-methyl-5-oxopiperazine-2-carboxamide
CID 107436389
N-(3-cyanophenyl)-N-methylcycloheptanecarboxamide
CID 62780707
3-(2-chlorophenyl)-1-(4-cyanophenyl)-1-methylurea
CID 62981730
N-(4-cyanophenyl)-3-(dimethylamino)-N-methylbenzamide
CID 62983461
1-amino-N-(4-cyanophenyl)-N-methylcyclopentane-1-carboxamide
CID 55141779
2-bromo-N-(4-cyanophenyl)-N-methylacetamide
CID 63679745

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide (CID 106737122) is N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide is CN(C(=O)C1Cc2ccccc2C1)c1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is RBTZPFSGLZYQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c1-20(17-8-6-13(12-19)7-9-17)18(21)16-10-14-4-2-3-5-15(14)11-16/h2-9,16H,10-11H2,1H3.
What are the key properties of N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide?
N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-N-methyl-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106737122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).