1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine

C17H33NO — CID 105044588

IUPAC1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine
SMILESCNC(C(C)CCOC)C1CCC2CCCCC2C1
InChIInChI=1S/C17H33NO/c1-13(10-11-19-3)17(18-2)16-9-8-14-6-4-5-7-15(14)12-16/h13-18H,4-12H2,1-3H3
InChIKeyQIEVEEIEJDLEAP-UHFFFAOYSA-N
MW267.46 g/mol
LogP3.85
Rot. Bonds6

About 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine (PubChem CID 105044588) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine.

Molecular Properties

Compound Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine
PubChem CID105044588
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine
SMILESCNC(C(C)CCOC)C1CCC2CCCCC2C1
InChIInChI=1S/C17H33NO/c1-13(10-11-19-3)17(18-2)16-9-8-14-6-4-5-7-15(14)12-16/h13-18H,4-12H2,1-3H3
InChIKeyQIEVEEIEJDLEAP-UHFFFAOYSA-N
XLogP3.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine with MolForge

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Related Compounds

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-2-methyl-N-propylbutan-1-amine
CID 105044293
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1-cyclopropyl-N-methylmethanamine
CID 104994252
(2R,4aS,8aR)-2-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 129374932
2-(dimethoxymethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 154554041
2-cyclopropyl-6-methoxy-4-methylhexan-3-ol
CID 115836210
1-cyclooctyl-N,2-dimethylpentan-1-amine
CID 107893689
3-methoxy-N-methyl-1-(4-methylcyclohexyl)propan-1-amine
CID 62604714
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-N-ethylethanamine
CID 115781927
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-methylpentan-1-amine
CID 107893950
[4-methoxy-2-methyl-1-(oxan-2-yl)butyl]hydrazine
CID 105337937
[4-methoxy-2-methyl-1-[4-(trifluoromethyl)cyclohexyl]butyl]hydrazine
CID 105338042
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)ethylhydrazine
CID 105282551

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine?
The IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine (CID 105044588) is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine.
What is the SMILES notation for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine?
The canonical SMILES for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine is CNC(C(C)CCOC)C1CCC2CCCCC2C1.
What is the InChIKey of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine?
The InChIKey is QIEVEEIEJDLEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-13(10-11-19-3)17(18-2)16-9-8-14-6-4-5-7-15(14)12-16/h13-18H,4-12H2,1-3H3.
What are the key properties of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine?
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine has a molecular weight of 267.46 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-methoxy-N,2-dimethylbutan-1-amine is sourced from PubChem (CID 105044588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).