2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine

C12H23NO2 — CID 106824190

IUPAC2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine
SMILESCCCNC1CCOC2(C1)CC(OC)C2
InChIInChI=1S/C12H23NO2/c1-3-5-13-10-4-6-15-12(7-10)8-11(9-12)14-2/h10-11,13H,3-9H2,1-2H3
InChIKeyQZKWDYZTCHGIJQ-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.71
Rot. Bonds4

About 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine

2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine (PubChem CID 106824190) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine.

Molecular Properties

Compound Name2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine
PubChem CID106824190
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine
SMILESCCCNC1CCOC2(C1)CC(OC)C2
InChIInChI=1S/C12H23NO2/c1-3-5-13-10-4-6-15-12(7-10)8-11(9-12)14-2/h10-11,13H,3-9H2,1-2H3
InChIKeyQZKWDYZTCHGIJQ-UHFFFAOYSA-N
XLogP1.71
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-methyl-N-propyl-1-oxaspiro[5.6]dodecan-4-amine
CID 65082535
N-butyl-1-oxaspiro[5.5]undecan-4-amine
CID 79897622
10-(2-methylpropyl)-N-propyl-1-oxaspiro[5.5]undecan-4-amine
CID 107430383
N-(3-propoxypropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 82941325
N-(2-butoxyethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895357
N-octyl-1-oxa-9-thiaspiro[5.5]undecan-4-amine
CID 115567507
N-(3-propoxypropyl)-1-oxa-9-thiaspiro[5.5]undecan-4-amine
CID 82944251
N-(3-methoxypropyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79898117
N-(4-methoxybutyl)-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79894953
methyl 3-(1,9-dioxaspiro[5.5]undecan-4-ylamino)propanoate
CID 79894913
N-[2-(2-methoxyethoxy)ethyl]-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79895389
N-(2-cyclopentyloxyethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903516

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine?
The IUPAC name of 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine (CID 106824190) is 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine.
What is the SMILES notation for 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine?
The canonical SMILES for 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine is CCCNC1CCOC2(C1)CC(OC)C2.
What is the InChIKey of 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine?
The InChIKey is QZKWDYZTCHGIJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-5-13-10-4-6-15-12(7-10)8-11(9-12)14-2/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine?
2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine has a molecular weight of 213.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-propyl-5-oxaspiro[3.5]nonan-8-amine is sourced from PubChem (CID 106824190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).