8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine

C17H27NO2 — CID 19377028

IUPAC8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCC(CCOC)NC1CCc2cccc(OC)c2C1
InChIInChI=1S/C17H27NO2/c1-4-14(10-11-19-2)18-15-9-8-13-6-5-7-17(20-3)16(13)12-15/h5-7,14-15,18H,4,8-12H2,1-3H3
InChIKeyUUMDXUHWYHNLOK-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.96
Rot. Bonds7

About 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine

8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 19377028) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID19377028
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCC(CCOC)NC1CCc2cccc(OC)c2C1
InChIInChI=1S/C17H27NO2/c1-4-14(10-11-19-2)18-15-9-8-13-6-5-7-17(20-3)16(13)12-15/h5-7,14-15,18H,4,8-12H2,1-3H3
InChIKeyUUMDXUHWYHNLOK-UHFFFAOYSA-N
XLogP2.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl propaneperoxoate
CID 19377067
N-[3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl]methanesulfonamide
CID 19377065
N-[3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl]methanesulfonamide;hydrochloride
CID 19377083
N,N-diethyl-3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentanamide
CID 19377092
N-[3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl]-1-phenylmethanesulfonamide
CID 67870487
3-chloro-N-[3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl]propane-1-sulfonamide;dihydrochloride
CID 19377066
N-(cyclopropylmethyl)-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 18331788
N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide
CID 18976441
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312
(2R)-N-benzyl-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 22866782
1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-N-methylmethanamine
CID 112547016
8-methoxy-N,N-bis(2-methoxyethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 18331804

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine (CID 19377028) is 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine is CCC(CCOC)NC1CCc2cccc(OC)c2C1.
What is the InChIKey of 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is UUMDXUHWYHNLOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-4-14(10-11-19-2)18-15-9-8-13-6-5-7-17(20-3)16(13)12-15/h5-7,14-15,18H,4,8-12H2,1-3H3.
What are the key properties of 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 277.41 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 19377028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).