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

C17H27NO2 — CID 103845700

IUPAC1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol
SMILESCCCC(C)(O)CNC1CCc2ccc(OC)cc2C1
InChIInChI=1S/C17H27NO2/c1-4-9-17(2,19)12-18-15-7-5-13-6-8-16(20-3)11-14(13)10-15/h6,8,11,15,18-19H,4-5,7,9-10,12H2,1-3H3
InChIKeyVUXWEADRFLARQK-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.69
Rot. Bonds6

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

1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol (PubChem CID 103845700) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol.

Molecular Properties

Compound Name1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol
PubChem CID103845700
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol
SMILESCCCC(C)(O)CNC1CCc2ccc(OC)cc2C1
InChIInChI=1S/C17H27NO2/c1-4-9-17(2,19)12-18-15-7-5-13-6-8-16(20-3)11-14(13)10-15/h6,8,11,15,18-19H,4-5,7,9-10,12H2,1-3H3
InChIKeyVUXWEADRFLARQK-UHFFFAOYSA-N
XLogP2.69
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol with MolForge

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Related Compounds

7-methoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 10082172
1-[2-[[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]amino]ethylsulfanyl]-2-methylpropan-2-ol
CID 97326402
4-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2,2-dimethylbutanoic acid
CID 122127288
N-tert-butyl-2-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]acetamide
CID 115510654
N'-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
CID 115510402
(3S)-4-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2,3-diphenylbutane-1,3-diol
CID 70446938
N-(2-ethoxypropyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115763357
ethyl 4-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]butanoate
CID 115510557
N-(3-fluoropropyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
CID 75441597
1-[(6-bromo-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-4-methoxy-2-methylbutan-2-ol
CID 103784233
tert-butyl N-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)carbamate
CID 22182075
7-methoxy-N-(4-methoxybutyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115510465

Frequently Asked Questions

What is the IUPAC name of 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol?
The IUPAC name of 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol (CID 103845700) is 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol.
What is the SMILES notation for 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol?
The canonical SMILES for 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol is CCCC(C)(O)CNC1CCc2ccc(OC)cc2C1.
What is the InChIKey of 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol?
The InChIKey is VUXWEADRFLARQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-4-9-17(2,19)12-18-15-7-5-13-6-8-16(20-3)11-14(13)10-15/h6,8,11,15,18-19H,4-5,7,9-10,12H2,1-3H3.
What are the key properties of 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol?
1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol has a molecular weight of 277.41 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-methylpentan-2-ol is sourced from PubChem (CID 103845700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).