N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine

C11H23NO — CID 103093411

IUPACN-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine
SMILESCCNC(C)C(C)=CC(C)COC
InChIInChI=1S/C11H23NO/c1-6-12-11(4)10(3)7-9(2)8-13-5/h7,9,11-12H,6,8H2,1-5H3
InChIKeyIKLNZQSKMIFZJU-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.21
Rot. Bonds6

About N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine

N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine (PubChem CID 103093411) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine.

Molecular Properties

Compound NameN-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine
PubChem CID103093411
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine
SMILESCCNC(C)C(C)=CC(C)COC
InChIInChI=1S/C11H23NO/c1-6-12-11(4)10(3)7-9(2)8-13-5/h7,9,11-12H,6,8H2,1-5H3
InChIKeyIKLNZQSKMIFZJU-UHFFFAOYSA-N
XLogP2.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-3,5-dimethylhex-3-en-2-amine
CID 103093389
N-ethyl-5-methoxy-2,4-dimethylpent-2-en-1-amine
CID 104881853
(Z)-5-methoxy-2,4-dimethylpent-2-en-1-ol
CID 116503510
N-ethyl-1-methoxy-5-methylhex-4-en-3-amine
CID 79190520
N-ethyl-5-methoxy-4-methylpentan-2-amine
CID 79569405
(2S)-N-ethyl-3-methylbut-3-en-2-amine
CID 89198318
N-ethyl-2-methoxy-5-methylhex-4-en-3-amine
CID 79616583
ethane;3-(ethylamino)butan-2-one
CID 145148121
2-[2-(ethylamino)-3-methoxypropyl]sulfanylpropan-1-ol
CID 107511551
(2S)-2-(ethylamino)-3-methoxypropanoic acid
CID 149367077
(E)-4-(3-chloro-4,5-dimethoxyphenyl)-N-ethyl-3-methylbut-3-en-2-amine
CID 103093259
N-ethyl-4-methoxy-5-methylhex-1-yn-3-amine
CID 116720318

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine?
The IUPAC name of N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine (CID 103093411) is N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine.
What is the SMILES notation for N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine?
The canonical SMILES for N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine is CCNC(C)C(C)=CC(C)COC.
What is the InChIKey of N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine?
The InChIKey is IKLNZQSKMIFZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-6-12-11(4)10(3)7-9(2)8-13-5/h7,9,11-12H,6,8H2,1-5H3.
What are the key properties of N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine?
N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methoxy-3,5-dimethylhex-3-en-2-amine is sourced from PubChem (CID 103093411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).