5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

C18H20N2O — CID 62304912

IUPAC5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC1CCCc2ccccc21
InChIInChI=1S/C18H20N2O/c1-12-9-10-14(19)11-16(12)18(21)20-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,9-11,17H,4,6,8,19H2,1H3,(H,20,21)
InChIKeyWKHJECSILYTYMI-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.38
Rot. Bonds2

About 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide (PubChem CID 62304912) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
PubChem CID62304912
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC1CCCc2ccccc21
InChIInChI=1S/C18H20N2O/c1-12-9-10-14(19)11-16(12)18(21)20-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,9-11,17H,4,6,8,19H2,1H3,(H,20,21)
InChIKeyWKHJECSILYTYMI-UHFFFAOYSA-N
XLogP3.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2,5-dimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 7919785
2-amino-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 60682216
2-methyl-5-piperidin-1-ylsulfonyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2361857
2,5-dichloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2124760
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-5-chloro-2-methylbenzamide
CID 82870824
N-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-2-iodobenzamide
CID 116649772
2-amino-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-carboxamide
CID 62072951
3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2-oxazole-4-carboxamide
CID 11149532
5-amino-2-methyl-N-[4-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazol-5-yl]benzamide;hydrochloride
CID 120626408
2-(3-aminophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 62499039
2,5-difluoro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 27184099
3-(methanesulfonamido)-2-methyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 94012657

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
The IUPAC name of 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide (CID 62304912) is 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide.
What is the SMILES notation for 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
The canonical SMILES for 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide is Cc1ccc(N)cc1C(=O)NC1CCCc2ccccc21.
What is the InChIKey of 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
The InChIKey is WKHJECSILYTYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-12-9-10-14(19)11-16(12)18(21)20-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,9-11,17H,4,6,8,19H2,1H3,(H,20,21).
What are the key properties of 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 3.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide is sourced from PubChem (CID 62304912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).