2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide

C20H22N2O2 — CID 56783711

IUPAC2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide
SMILESCc1c(NC(=O)CC2CCCc3ccccc32)cccc1C(N)=O
InChIInChI=1S/C20H22N2O2/c1-13-16(20(21)24)10-5-11-18(13)22-19(23)12-15-8-4-7-14-6-2-3-9-17(14)15/h2-3,5-6,9-11,15H,4,7-8,12H2,1H3,(H2,21,24)(H,22,23)
InChIKeyLYLBOWLQZHBMAX-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.54
Rot. Bonds4

About 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide

2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide (PubChem CID 56783711) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound Name2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide
PubChem CID56783711
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide
SMILESCc1c(NC(=O)CC2CCCc3ccccc32)cccc1C(N)=O
InChIInChI=1S/C20H22N2O2/c1-13-16(20(21)24)10-5-11-18(13)22-19(23)12-15-8-4-7-14-6-2-3-9-17(14)15/h2-3,5-6,9-11,15H,4,7-8,12H2,1H3,(H2,21,24)(H,22,23)
InChIKeyLYLBOWLQZHBMAX-UHFFFAOYSA-N
XLogP3.54
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-2-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide
CID 120604447
N-[2-(ethylaminomethyl)phenyl]-2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 119440025
methyl 2-[[2-(2,3-dihydro-1H-inden-1-yl)acetyl]amino]benzoate
CID 86955196
3-[[2-(cyclopropylmethylamino)acetyl]amino]-2-methylbenzamide
CID 54925416
1-methyl-4-[[2-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetyl]amino]pyrrole-2-carboxamide
CID 95617018
2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-N-[2-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]phenyl]acetamide
CID 97260269
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 95616896
2-[[2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)acetyl]amino]benzamide
CID 134049123
N-(6-amino-1,3-benzodioxol-5-yl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide;hydrochloride
CID 119618623
3-[(2-chloroacetyl)amino]-2-methylbenzamide
CID 43698457
N-(6-amino-3-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide;hydrochloride
CID 119515915
N-[(3-methoxy-2-methylphenyl)methyl]-2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 167812395

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide?
The IUPAC name of 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide (CID 56783711) is 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide?
The canonical SMILES for 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide is Cc1c(NC(=O)CC2CCCc3ccccc32)cccc1C(N)=O.
What is the InChIKey of 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide?
The InChIKey is LYLBOWLQZHBMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-13-16(20(21)24)10-5-11-18(13)22-19(23)12-15-8-4-7-14-6-2-3-9-17(14)15/h2-3,5-6,9-11,15H,4,7-8,12H2,1H3,(H2,21,24)(H,22,23).
What are the key properties of 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide?
2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide has a molecular weight of 322.41 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 56783711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).