3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide

C14H19NO2 — CID 102420215

IUPAC3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
SMILESCOc1cccc2c1CC(CCC(N)=O)CC2
InChIInChI=1S/C14H19NO2/c1-17-13-4-2-3-11-7-5-10(9-12(11)13)6-8-14(15)16/h2-4,10H,5-9H2,1H3,(H2,15,16)
InChIKeyYTGUNNGASBNUQI-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.07
Rot. Bonds4

About 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide

3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide (PubChem CID 102420215) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide.

Molecular Properties

Compound Name3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
PubChem CID102420215
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
SMILESCOc1cccc2c1CC(CCC(N)=O)CC2
InChIInChI=1S/C14H19NO2/c1-17-13-4-2-3-11-7-5-10(9-12(11)13)6-8-14(15)16/h2-4,10H,5-9H2,1H3,(H2,15,16)
InChIKeyYTGUNNGASBNUQI-UHFFFAOYSA-N
XLogP2.07
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine;hydrochloride
CID 19888691
1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-N-methylmethanamine
CID 112547016
2-[[(7S)-7-undecyl-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]acetic acid
CID 144530116
methyl 2-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetate
CID 15237997
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312
N-(cyclopropylmethyl)-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 18331788
methyl (2R)-4-methoxy-2,3-dihydro-1H-indene-2-carboxylate
CID 86315719
methyl 3-(6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanoate
CID 70363837
methyl 2-(8-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetate
CID 54298591
3-(5-methoxy-4-oxo-2,3-dihydro-1H-naphthalen-2-yl)propanoic acid
CID 18988823
(2S)-2-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 123510289
5-methoxy-1,2,3,4-tetrahydronaphthalene-2,3-diol
CID 123352888

Frequently Asked Questions

What is the IUPAC name of 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The IUPAC name of 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide (CID 102420215) is 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide.
What is the SMILES notation for 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The canonical SMILES for 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide is COc1cccc2c1CC(CCC(N)=O)CC2.
What is the InChIKey of 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The InChIKey is YTGUNNGASBNUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-17-13-4-2-3-11-7-5-10(9-12(11)13)6-8-14(15)16/h2-4,10H,5-9H2,1H3,(H2,15,16).
What are the key properties of 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide has a molecular weight of 233.31 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide is sourced from PubChem (CID 102420215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).