7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol

C17H27NO2 — CID 79247603

IUPAC7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCCN(C(C)C)C1CCc2ccc(OC)cc2C1O
InChIInChI=1S/C17H27NO2/c1-5-10-18(12(2)3)16-9-7-13-6-8-14(20-4)11-15(13)17(16)19/h6,8,11-12,16-17,19H,5,7,9-10H2,1-4H3
InChIKeyUYDRAHANIOPDMF-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.16
Rot. Bonds5

About 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol

7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 79247603) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID79247603
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCCN(C(C)C)C1CCc2ccc(OC)cc2C1O
InChIInChI=1S/C17H27NO2/c1-5-10-18(12(2)3)16-9-7-13-6-8-14(20-4)11-15(13)17(16)19/h6,8,11-12,16-17,19H,5,7,9-10H2,1-4H3
InChIKeyUYDRAHANIOPDMF-UHFFFAOYSA-N
XLogP3.16
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-2-N-propan-2-yl-2-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 43269499
2-[cyclopropyl(methyl)amino]-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 79247998
2-[cyclobutylmethyl(methyl)amino]-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 79248312
2-[ethyl(2-methylpropyl)amino]-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79374084
2-amino-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol;hydrochloride
CID 52911309
7-methoxy-1-N,1-N-dipropyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 70468404
2-N-ethyl-7-methoxy-2-N-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 79248139
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol
CID 79368775
7-methoxy-2-(2,2,2-trifluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 79248625
6-methoxy-2,3-dihydro-1H-indene-1-thiol
CID 79374496
2-[cycloheptyl(methyl)amino]-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79372170
6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
CID 82947826

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol (CID 79247603) is 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol is CCCN(C(C)C)C1CCc2ccc(OC)cc2C1O.
What is the InChIKey of 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is UYDRAHANIOPDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-5-10-18(12(2)3)16-9-7-13-6-8-14(20-4)11-15(13)17(16)19/h6,8,11-12,16-17,19H,5,7,9-10H2,1-4H3.
What are the key properties of 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 277.41 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-[propan-2-yl(propyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 79247603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).