(5-methoxyspiro[2.3]hexan-2-yl)methanamine

C8H15NO — CID 106824122

IUPAC(5-methoxyspiro[2.3]hexan-2-yl)methanamine
SMILESCOC1CC2(C1)CC2CN
InChIInChI=1S/C8H15NO/c1-10-7-3-8(4-7)2-6(8)5-9/h6-7H,2-5,9H2,1H3
InChIKeyZIRPUXVZPBJIGN-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.76
Rot. Bonds2

About (5-methoxyspiro[2.3]hexan-2-yl)methanamine

(5-methoxyspiro[2.3]hexan-2-yl)methanamine (PubChem CID 106824122) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (5-methoxyspiro[2.3]hexan-2-yl)methanamine.

Molecular Properties

Compound Name(5-methoxyspiro[2.3]hexan-2-yl)methanamine
PubChem CID106824122
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(5-methoxyspiro[2.3]hexan-2-yl)methanamine
SMILESCOC1CC2(C1)CC2CN
InChIInChI=1S/C8H15NO/c1-10-7-3-8(4-7)2-6(8)5-9/h6-7H,2-5,9H2,1H3
InChIKeyZIRPUXVZPBJIGN-UHFFFAOYSA-N
XLogP0.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(7-methoxyspiro[2.5]octan-2-yl)methanamine
CID 106874327
(5-ethoxyspiro[2.3]hexan-2-yl)methanamine
CID 106824123
[(2R)-spiro[2.4]heptan-2-yl]methanamine
CID 94557824
methyl 2-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate
CID 84668362
(6-propan-2-ylspiro[2.5]octan-2-yl)methanamine
CID 62707779
(5,5-dioxo-5λ6-thiaspiro[2.3]hexan-2-yl)methanamine
CID 84651273
2-(chloromethyl)-7-methoxyspiro[2.5]octane
CID 106875015
(3,5-dimethoxycyclohexyl)methanamine
CID 123884100
(5-methoxy-3,3-dimethylcyclohexyl)methanamine;hydrochloride
CID 71741933
N-[1-(aminomethyl)-3-methoxycyclobutyl]-N-methylcyclohexanamine
CID 106821681
[(2R,3S)-5-oxaspiro[2.4]heptan-2-yl]methanamine
CID 124508591
spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-ylmethanamine
CID 62708148

Frequently Asked Questions

What is the IUPAC name of (5-methoxyspiro[2.3]hexan-2-yl)methanamine?
The IUPAC name of (5-methoxyspiro[2.3]hexan-2-yl)methanamine (CID 106824122) is (5-methoxyspiro[2.3]hexan-2-yl)methanamine.
What is the SMILES notation for (5-methoxyspiro[2.3]hexan-2-yl)methanamine?
The canonical SMILES for (5-methoxyspiro[2.3]hexan-2-yl)methanamine is COC1CC2(C1)CC2CN.
What is the InChIKey of (5-methoxyspiro[2.3]hexan-2-yl)methanamine?
The InChIKey is ZIRPUXVZPBJIGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-10-7-3-8(4-7)2-6(8)5-9/h6-7H,2-5,9H2,1H3.
What are the key properties of (5-methoxyspiro[2.3]hexan-2-yl)methanamine?
(5-methoxyspiro[2.3]hexan-2-yl)methanamine has a molecular weight of 141.21 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxyspiro[2.3]hexan-2-yl)methanamine is sourced from PubChem (CID 106824122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).