N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide

C18H16N2O — CID 23963756

IUPACN-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc2c(c1)CCCC2
InChIInChI=1S/C18H16N2O/c19-12-16-7-3-4-8-17(16)20-18(21)15-10-9-13-5-1-2-6-14(13)11-15/h3-4,7-11H,1-2,5-6H2,(H,20,21)
InChIKeyUUKVWXCYSDEAGP-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.69
Rot. Bonds2

About N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide

N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide (PubChem CID 23963756) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
PubChem CID23963756
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC NameN-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc2c(c1)CCCC2
InChIInChI=1S/C18H16N2O/c19-12-16-7-3-4-8-17(16)20-18(21)15-10-9-13-5-1-2-6-14(13)11-15/h3-4,7-11H,1-2,5-6H2,(H,20,21)
InChIKeyUUKVWXCYSDEAGP-UHFFFAOYSA-N
XLogP3.69
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 798668
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N-(2-cyanophenyl)-1H-indole-5-carboxamide
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N-(2-cyanophenyl)-4-methylbenzamide
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N-[2-(methanesulfonamido)phenyl]-2,3-dihydro-1H-indene-5-carboxamide
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(2R)-N-(2-cyanophenyl)-2-(2,3-dihydro-1H-inden-5-yloxy)propanamide
CID 7643000
3-benzamido-N-(2-cyanophenyl)-4-methylbenzamide
CID 17226453
N-(2-cyanophenyl)-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044383
3-amino-N-(2-cyanophenyl)-4-methoxybenzamide
CID 16788313
N-[2-(benzylcarbamoyl)phenyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100703574
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CID 9471660

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide (CID 23963756) is N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide is N#Cc1ccccc1NC(=O)c1ccc2c(c1)CCCC2.
What is the InChIKey of N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The InChIKey is UUKVWXCYSDEAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c19-12-16-7-3-4-8-17(16)20-18(21)15-10-9-13-5-1-2-6-14(13)11-15/h3-4,7-11H,1-2,5-6H2,(H,20,21).
What are the key properties of N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 23963756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).