N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide

C20H24N2O3 — CID 42996619

IUPACN-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
SMILESCOc1ccc(NC(=O)CNc2cccc3c2CCCC3)c(OC)c1
InChIInChI=1S/C20H24N2O3/c1-24-15-10-11-18(19(12-15)25-2)22-20(23)13-21-17-9-5-7-14-6-3-4-8-16(14)17/h5,7,9-12,21H,3-4,6,8,13H2,1-2H3,(H,22,23)
InChIKeyDOQJSYDOEMKFBW-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.63
Rot. Bonds6

About N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide

N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide (PubChem CID 42996619) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
PubChem CID42996619
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
SMILESCOc1ccc(NC(=O)CNc2cccc3c2CCCC3)c(OC)c1
InChIInChI=1S/C20H24N2O3/c1-24-15-10-11-18(19(12-15)25-2)22-20(23)13-21-17-9-5-7-14-6-3-4-8-16(14)17/h5,7,9-12,21H,3-4,6,8,13H2,1-2H3,(H,22,23)
InChIKeyDOQJSYDOEMKFBW-UHFFFAOYSA-N
XLogP3.63
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797716
N-(2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797713
2-(4,5-dimethoxy-2-methylanilino)-N-(2,4-dimethoxyphenyl)acetamide
CID 9105392
2-(2,4-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide
CID 26438685
N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 37478676
N-(2-tert-butylphenyl)-2-(2,4-dimethoxyanilino)acetamide
CID 30567589
methyl 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetate
CID 43179666
2-(2,4-dimethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 37479068
2-(2,4-dimethoxyanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 8965693
2-[2-(difluoromethylsulfanyl)anilino]-N-(2,4-dimethoxyphenyl)acetamide
CID 17395137
N-(2-phenylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 55345448
N-(2,4-dimethoxyphenyl)-3-(2,3-dimethylanilino)propanamide
CID 109036046

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide (CID 42996619) is N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide is COc1ccc(NC(=O)CNc2cccc3c2CCCC3)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The InChIKey is DOQJSYDOEMKFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-24-15-10-11-18(19(12-15)25-2)22-20(23)13-21-17-9-5-7-14-6-3-4-8-16(14)17/h5,7,9-12,21H,3-4,6,8,13H2,1-2H3,(H,22,23).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide is sourced from PubChem (CID 42996619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).