5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine

C14H21NO — CID 115058079

IUPAC5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCOc1cccc2c1CCC(N)C2C(C)C
InChIInChI=1S/C14H21NO/c1-9(2)14-11-5-4-6-13(16-3)10(11)7-8-12(14)15/h4-6,9,12,14H,7-8,15H2,1-3H3
InChIKeyOYAUENYHXZUIKA-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.71
Rot. Bonds2

About 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine

5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 115058079) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID115058079
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCOc1cccc2c1CCC(N)C2C(C)C
InChIInChI=1S/C14H21NO/c1-9(2)14-11-5-4-6-13(16-3)10(11)7-8-12(14)15/h4-6,9,12,14H,7-8,15H2,1-3H3
InChIKeyOYAUENYHXZUIKA-UHFFFAOYSA-N
XLogP2.71
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115058068
5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 70349932
(2S)-2-amino-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119317459
2-amino-2-(4-methoxy-2,3-dihydro-1H-inden-1-yl)acetic acid
CID 83910520
(5-methoxy-1-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 115058016
1-benzyl-5-methoxy-1,2,3,4-tetrahydronaphthalene
CID 72942489
N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
CID 61383418
8-methoxy-1-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-one
CID 135041499
2-fluoro-2-(4-methoxy-2,3-dihydro-1H-inden-1-yl)acetic acid
CID 105481651
5-methoxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 115057140
7-methoxy-1,2,3,4,4a,5,6,10b-octahydrobenzo[h]quinoline
CID 83887769
(3aS,9bS)-6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindol-2-ium chloride
CID 10847615

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 115058079) is 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine is COc1cccc2c1CCC(N)C2C(C)C.
What is the InChIKey of 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is OYAUENYHXZUIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9(2)14-11-5-4-6-13(16-3)10(11)7-8-12(14)15/h4-6,9,12,14H,7-8,15H2,1-3H3.
What are the key properties of 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 115058079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).