N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine

C11H23NO — CID 147933934

IUPACN,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine
SMILESC=C(OC(C)C)C(CC(C)C)NC
InChIInChI=1S/C11H23NO/c1-8(2)7-11(12-6)10(5)13-9(3)4/h8-9,11-12H,5,7H2,1-4,6H3
InChIKeyIKKRMZVLLZMYMK-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.56
Rot. Bonds6

About N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine

N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine (PubChem CID 147933934) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine.

Molecular Properties

Compound NameN,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine
PubChem CID147933934
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine
SMILESC=C(OC(C)C)C(CC(C)C)NC
InChIInChI=1S/C11H23NO/c1-8(2)7-11(12-6)10(5)13-9(3)4/h8-9,11-12H,5,7H2,1-4,6H3
InChIKeyIKKRMZVLLZMYMK-UHFFFAOYSA-N
XLogP2.56
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 ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2-Ethoxy-5-methylhex-1-en-3-amine
CID 88997329
N-ethyl-2-methoxy-4-methylpent-1-en-3-amine
CID 89244092
N,3-dimethyl-2-pentoxypent-1-en-3-amine
CID 123541775
N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine
CID 123675374
2-ethoxy-N-hex-1-en-2-yl-4-methylpent-1-en-3-amine
CID 129043449
(3S)-N,5-dimethyl-2-[(2-methylpropan-2-yl)oxy]hex-1-en-3-amine;propane
CID 141929832
2-Methoxy-5-methylhex-1-en-3-amine
CID 143142421
ethane;N-ethyl-2-methoxy-4-methylpent-1-en-3-amine
CID 145468293
(3R)-N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine
CID 145642012
N-ethynyl-2-methyl-4-propoxyhept-6-en-3-amine
CID 146184300
1-but-1-en-2-yloxy-N,3-dimethylbutan-2-amine
CID 155276622
2-[(1R)-1-(5-methylhexan-2-yloxy)ethyl]-1,2,3,4-tetrahydropyridine
CID 156395324

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine?
The IUPAC name of N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine (CID 147933934) is N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine.
What is the SMILES notation for N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine?
The canonical SMILES for N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine is C=C(OC(C)C)C(CC(C)C)NC.
What is the InChIKey of N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine?
The InChIKey is IKKRMZVLLZMYMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-8(2)7-11(12-6)10(5)13-9(3)4/h8-9,11-12H,5,7H2,1-4,6H3.
What are the key properties of N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine?
N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine has a molecular weight of 185.31 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine is sourced from PubChem (CID 147933934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).