N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide

C14H17NO — CID 153344139

IUPACN-(5,6-dihydronaphthalen-1-ylmethyl)propanamide
SMILESCCC(=O)NCc1cccc2c1C=CCC2
InChIInChI=1S/C14H17NO/c1-2-14(16)15-10-12-8-5-7-11-6-3-4-9-13(11)12/h4-5,7-9H,2-3,6,10H2,1H3,(H,15,16)
InChIKeyFXIAZJGBDGKXNG-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.67
Rot. Bonds3

About N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide

N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide (PubChem CID 153344139) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide.

Molecular Properties

Compound NameN-(5,6-dihydronaphthalen-1-ylmethyl)propanamide
PubChem CID153344139
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-(5,6-dihydronaphthalen-1-ylmethyl)propanamide
SMILESCCC(=O)NCc1cccc2c1C=CCC2
InChIInChI=1S/C14H17NO/c1-2-14(16)15-10-12-8-5-7-11-6-3-4-9-13(11)12/h4-5,7-9H,2-3,6,10H2,1H3,(H,15,16)
InChIKeyFXIAZJGBDGKXNG-UHFFFAOYSA-N
XLogP2.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

tert-butyl N-[(2S)-1-(5,6-dihydronaphthalen-1-ylmethylamino)-1-oxopropan-2-yl]carbamate
CID 139397582
ethane;methyl (2R)-3-(5,6-dihydronaphthalen-1-yl)-2-methylpropanoate
CID 142994213
1-(5,6-dihydronaphthalen-1-yl)-2-methylbutan-1-one
CID 177180647
N-(5,6-dihydronaphthalen-1-ylsulfonyl)acetamide;ethane
CID 144593271
N-(1H-indol-4-ylmethyl)propanamide
CID 176935116
N-oxo-5,6-dihydronaphthalene-1-carboxamide
CID 89159076
N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
CID 60674556
N-[[(4aE,6Z,10Z)-8,9-dihydrobenzo[8]annulen-5-yl]methyl]propanamide
CID 142272415
N-[[2-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]propanamide
CID 111520289
2-[2-(5,6-dihydronaphthalen-1-yl)ethylsulfanylamino]-2-methyl-N-[(7-methyl-3-bicyclo[3.3.1]nonanyl)methyl]propanamide
CID 144523052
N-[(2,4,5-trimethylphenyl)methyl]propanamide
CID 110783031
N-[(2,3,4-trifluorophenyl)methyl]propanamide
CID 110477463

Frequently Asked Questions

What is the IUPAC name of N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide?
The IUPAC name of N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide (CID 153344139) is N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide.
What is the SMILES notation for N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide?
The canonical SMILES for N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide is CCC(=O)NCc1cccc2c1C=CCC2.
What is the InChIKey of N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide?
The InChIKey is FXIAZJGBDGKXNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-2-14(16)15-10-12-8-5-7-11-6-3-4-9-13(11)12/h4-5,7-9H,2-3,6,10H2,1H3,(H,15,16).
What are the key properties of N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide?
N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide has a molecular weight of 215.30 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dihydronaphthalen-1-ylmethyl)propanamide is sourced from PubChem (CID 153344139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).