N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide

C19H21FN2O — CID 37478676

IUPACN-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
SMILESCc1ccc(F)cc1NC(=O)CNc1cccc2c1CCCC2
InChIInChI=1S/C19H21FN2O/c1-13-9-10-15(20)11-18(13)22-19(23)12-21-17-8-4-6-14-5-2-3-7-16(14)17/h4,6,8-11,21H,2-3,5,7,12H2,1H3,(H,22,23)
InChIKeyJIJITQNKHLDZAQ-UHFFFAOYSA-N
MW312.39 g/mol
LogP4.06
Rot. Bonds4

About N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide

N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide (PubChem CID 37478676) has the molecular formula C19H21FN2O and a molecular weight of 312.39 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
PubChem CID37478676
Molecular FormulaC19H21FN2O
Molecular Weight312.39 g/mol
Exact Mass312.16
IUPAC NameN-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
SMILESCc1ccc(F)cc1NC(=O)CNc1cccc2c1CCCC2
InChIInChI=1S/C19H21FN2O/c1-13-9-10-15(20)11-18(13)22-19(23)12-21-17-8-4-6-14-5-2-3-7-16(14)17/h4,6,8-11,21H,2-3,5,7,12H2,1H3,(H,22,23)
InChIKeyJIJITQNKHLDZAQ-UHFFFAOYSA-N
XLogP4.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(tert-butylcarbamoyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 26509429
N-(2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797713
N-(2-phenylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 55345448
2-(3-fluorophenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 26515848
N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 42996619
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797716
methyl 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetate
CID 43179666
tert-butyl N-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethyl]carbamate
CID 60596283
N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 60681149
2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide
CID 18096453
2-(2,5-difluoroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 42069511
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide (CID 37478676) is N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide is Cc1ccc(F)cc1NC(=O)CNc1cccc2c1CCCC2.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The InChIKey is JIJITQNKHLDZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O/c1-13-9-10-15(20)11-18(13)22-19(23)12-21-17-8-4-6-14-5-2-3-7-16(14)17/h4,6,8-11,21H,2-3,5,7,12H2,1H3,(H,22,23).
What are the key properties of N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide has a molecular weight of 312.39 g/mol, XLogP of 4.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide is sourced from PubChem (CID 37478676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).