6-methoxy-N,N-dimethylcyclohex-3-en-1-amine

C9H17NO — CID 144608699

IUPAC6-methoxy-N,N-dimethylcyclohex-3-en-1-amine
SMILESCOC1CC=CCC1N(C)C
InChIInChI=1S/C9H17NO/c1-10(2)8-6-4-5-7-9(8)11-3/h4-5,8-9H,6-7H2,1-3H3
InChIKeySSPGLAMMUBKIIE-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.28
Rot. Bonds2

About 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine

6-methoxy-N,N-dimethylcyclohex-3-en-1-amine (PubChem CID 144608699) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine.

Molecular Properties

Compound Name6-methoxy-N,N-dimethylcyclohex-3-en-1-amine
PubChem CID144608699
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name6-methoxy-N,N-dimethylcyclohex-3-en-1-amine
SMILESCOC1CC=CCC1N(C)C
InChIInChI=1S/C9H17NO/c1-10(2)8-6-4-5-7-9(8)11-3/h4-5,8-9H,6-7H2,1-3H3
InChIKeySSPGLAMMUBKIIE-UHFFFAOYSA-N
XLogP1.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(4-fluorocyclohex-3-en-1-yl)oxy-N,N-dimethylethanamine
CID 129059984
N-ethyl-N-methyl-6-propan-2-yloxycyclohex-2-en-1-amine
CID 89019468
(Z,5R)-N-ethyl-5-methoxy-N-methylnon-2-en-4-amine
CID 89276213
4-Propan-2-yl-2,3,4a,5,8,8a-hexahydro-1,4-benzoxazine
CID 89973811
N-(2-hept-5-en-3-yloxyethyl)-N-methylpent-4-en-1-amine
CID 123179565
4-Methyl-2,3,4a,5,8,8a-hexahydro-1,4-benzoxazine
CID 134352996
N-ethenyl-6-methoxy-N-methylcyclohex-3-en-1-amine
CID 144329034
N-cyclohex-3-en-1-yl-N-methyloxetan-3-amine;ethane
CID 145406693
Ethane;2-(1-methoxyethyl)-1-methyl-2,5-dihydropyrrole
CID 177009307
methane;(2S)-2-[(1S)-1-methoxyethyl]-1-methyl-2,5-dihydropyrrole
CID 177009492
(Z,2S,3S)-2-methoxy-N,N-dimethylhex-4-en-3-amine
CID 177009627
ethane;2-[(1S)-1-methoxyethyl]-1-methyl-2,5-dihydropyrrole
CID 177009705

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine?
The IUPAC name of 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine (CID 144608699) is 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine.
What is the SMILES notation for 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine?
The canonical SMILES for 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine is COC1CC=CCC1N(C)C.
What is the InChIKey of 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine?
The InChIKey is SSPGLAMMUBKIIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-10(2)8-6-4-5-7-9(8)11-3/h4-5,8-9H,6-7H2,1-3H3.
What are the key properties of 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine?
6-methoxy-N,N-dimethylcyclohex-3-en-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,N-dimethylcyclohex-3-en-1-amine is sourced from PubChem (CID 144608699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).