N-ethyl-6-methoxyspiro[2.3]hexan-4-amine

C9H17NO — CID 167273954

IUPACN-ethyl-6-methoxyspiro[2.3]hexan-4-amine
SMILESCCNC1CC(OC)C12CC2
InChIInChI=1S/C9H17NO/c1-3-10-7-6-8(11-2)9(7)4-5-9/h7-8,10H,3-6H2,1-2H3
InChIKeyKEVXUOOLAGRTDY-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds3

About N-ethyl-6-methoxyspiro[2.3]hexan-4-amine

N-ethyl-6-methoxyspiro[2.3]hexan-4-amine (PubChem CID 167273954) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-ethyl-6-methoxyspiro[2.3]hexan-4-amine.

Molecular Properties

Compound NameN-ethyl-6-methoxyspiro[2.3]hexan-4-amine
PubChem CID167273954
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-ethyl-6-methoxyspiro[2.3]hexan-4-amine
SMILESCCNC1CC(OC)C12CC2
InChIInChI=1S/C9H17NO/c1-3-10-7-6-8(11-2)9(7)4-5-9/h7-8,10H,3-6H2,1-2H3
InChIKeyKEVXUOOLAGRTDY-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methoxyspiro[2.3]hexan-4-amine?
The IUPAC name of N-ethyl-6-methoxyspiro[2.3]hexan-4-amine (CID 167273954) is N-ethyl-6-methoxyspiro[2.3]hexan-4-amine.
What is the SMILES notation for N-ethyl-6-methoxyspiro[2.3]hexan-4-amine?
The canonical SMILES for N-ethyl-6-methoxyspiro[2.3]hexan-4-amine is CCNC1CC(OC)C12CC2.
What is the InChIKey of N-ethyl-6-methoxyspiro[2.3]hexan-4-amine?
The InChIKey is KEVXUOOLAGRTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-10-7-6-8(11-2)9(7)4-5-9/h7-8,10H,3-6H2,1-2H3.
What are the key properties of N-ethyl-6-methoxyspiro[2.3]hexan-4-amine?
N-ethyl-6-methoxyspiro[2.3]hexan-4-amine has a molecular weight of 155.24 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methoxyspiro[2.3]hexan-4-amine is sourced from PubChem (CID 167273954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).