N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide

C14H19NO2 — CID 67469984

IUPACN-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
SMILESCCC(=O)NC1CCc2c(cccc2OC)C1
InChIInChI=1S/C14H19NO2/c1-3-14(16)15-11-7-8-12-10(9-11)5-4-6-13(12)17-2/h4-6,11H,3,7-9H2,1-2H3,(H,15,16)
InChIKeySAEUBVASPHMFGN-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.08
Rot. Bonds3

About N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide

N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide (PubChem CID 67469984) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide.

Molecular Properties

Compound NameN-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
PubChem CID67469984
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
SMILESCCC(=O)NC1CCc2c(cccc2OC)C1
InChIInChI=1S/C14H19NO2/c1-3-14(16)15-11-7-8-12-10(9-11)5-4-6-13(12)17-2/h4-6,11H,3,7-9H2,1-2H3,(H,15,16)
InChIKeySAEUBVASPHMFGN-UHFFFAOYSA-N
XLogP2.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]propanamide
CID 68917081
N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 19773270
ethane;5-methoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 165394416
(2R)-5-methoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 10656511
(2S)-2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]hexanoic acid
CID 122044708
methyl 2-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetate
CID 15237997
1-[3-(methoxymethyl)cyclobutyl]-3-(1-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)urea
CID 154789320
5-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 12728224
5-methoxy-N-octyl-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 23635993
(6S)-1-methoxy-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-amine
CID 125494596
(6R)-1-methoxy-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-amine
CID 125494595
(3R)-N-[(2S)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]thiolan-3-amine
CID 125138715

Frequently Asked Questions

What is the IUPAC name of N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The IUPAC name of N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide (CID 67469984) is N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide.
What is the SMILES notation for N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The canonical SMILES for N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide is CCC(=O)NC1CCc2c(cccc2OC)C1.
What is the InChIKey of N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The InChIKey is SAEUBVASPHMFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-3-14(16)15-11-7-8-12-10(9-11)5-4-6-13(12)17-2/h4-6,11H,3,7-9H2,1-2H3,(H,15,16).
What are the key properties of N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide has a molecular weight of 233.31 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide is sourced from PubChem (CID 67469984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).