5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine

C13H17NO — CID 65008758

IUPAC5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine
SMILESCOc1ccccc1C1(N)CC2(CC2)C1
InChIInChI=1S/C13H17NO/c1-15-11-5-3-2-4-10(11)13(14)8-12(9-13)6-7-12/h2-5H,6-9,14H2,1H3
InChIKeyQIRJHQJATNDPIW-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.42
Rot. Bonds2

About 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine

5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine (PubChem CID 65008758) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine.

Molecular Properties

Compound Name5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine
PubChem CID65008758
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Name5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine
SMILESCOc1ccccc1C1(N)CC2(CC2)C1
InChIInChI=1S/C13H17NO/c1-15-11-5-3-2-4-10(11)13(14)8-12(9-13)6-7-12/h2-5H,6-9,14H2,1H3
InChIKeyQIRJHQJATNDPIW-UHFFFAOYSA-N
XLogP2.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-3-(2-methoxyphenyl)-1-methylcyclobutan-1-ol
CID 115025196
[5-(2-methoxyphenyl)spiro[2.3]hexan-5-yl]methanamine
CID 65008172
1-(2-methoxyphenyl)-4-methylcyclohexan-1-amine
CID 60793795
1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine
CID 64516240
2-(5-chloro-2-methoxyphenyl)spiro[3.4]octan-2-amine
CID 65002776
1-(2-methoxyphenyl)-4-methylcycloheptan-1-amine
CID 65081298
1-(1-fluorocyclopropyl)-2-methoxybenzene
CID 22940038
N-[[5-(2-methoxyphenyl)spiro[2.3]hexan-5-yl]methyl]propan-1-amine
CID 65008448
1-(2-methoxyphenyl)-2-methylcyclopentan-1-amine
CID 79680080
3-(2-methoxyphenyl)-3-methylpyrrolidine
CID 62354573
5-phenylspiro[2.3]hexan-5-amine
CID 65008648
3,3-dimethyl-1-[2-(trifluoromethoxy)phenyl]cyclopentan-1-amine
CID 80706187

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine?
The IUPAC name of 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine (CID 65008758) is 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine.
What is the SMILES notation for 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine?
The canonical SMILES for 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine is COc1ccccc1C1(N)CC2(CC2)C1.
What is the InChIKey of 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine?
The InChIKey is QIRJHQJATNDPIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-15-11-5-3-2-4-10(11)13(14)8-12(9-13)6-7-12/h2-5H,6-9,14H2,1H3.
What are the key properties of 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine?
5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine has a molecular weight of 203.29 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine is sourced from PubChem (CID 65008758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).