1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine

C14H27NO — CID 107009678

IUPAC1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine
SMILESC=CCCCCCC(NC)C1(OC)CCC1
InChIInChI=1S/C14H27NO/c1-4-5-6-7-8-10-13(15-2)14(16-3)11-9-12-14/h4,13,15H,1,5-12H2,2-3H3
InChIKeyMLACUUQFTJLORS-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.28
Rot. Bonds9

About 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine

1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine (PubChem CID 107009678) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine.

Molecular Properties

Compound Name1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine
PubChem CID107009678
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine
SMILESC=CCCCCCC(NC)C1(OC)CCC1
InChIInChI=1S/C14H27NO/c1-4-5-6-7-8-10-13(15-2)14(16-3)11-9-12-14/h4,13,15H,1,5-12H2,2-3H3
InChIKeyMLACUUQFTJLORS-UHFFFAOYSA-N
XLogP3.28
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(1-methoxycyclopentyl)oct-7-enylhydrazine
CID 107012644
1-(4-ethoxyoxan-4-yl)-N-methyloct-7-en-1-amine
CID 107009741
1-(1-methoxycyclobutyl)hex-5-en-1-ol
CID 116710636
N-ethyl-1-(1-methoxy-4-methylcyclohexyl)oct-7-en-1-amine
CID 107009746
N-ethyl-1-(1-methoxycyclobutyl)pent-4-en-1-amine
CID 116714654
1-(1-methoxycyclopentyl)hex-5-en-1-ol
CID 104610355
1-(1-methoxycycloheptyl)hex-5-en-1-ol
CID 116756031
1-(1-ethoxycyclopentyl)oct-7-en-1-ol
CID 107008722
1-(1-methoxycyclobutyl)heptylhydrazine
CID 105270416
1-(1-ethoxycyclopentyl)-N-methyldecan-1-amine
CID 116761887
4-ethylsulfonyl-1-(1-methoxycyclohexyl)-N-methylbutan-1-amine
CID 116762936
N-ethyl-1-(1-methoxy-4-methylcyclohexyl)hex-5-en-1-amine
CID 116766659

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine?
The IUPAC name of 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine (CID 107009678) is 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine.
What is the SMILES notation for 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine?
The canonical SMILES for 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine is C=CCCCCCC(NC)C1(OC)CCC1.
What is the InChIKey of 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine?
The InChIKey is MLACUUQFTJLORS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-5-6-7-8-10-13(15-2)14(16-3)11-9-12-14/h4,13,15H,1,5-12H2,2-3H3.
What are the key properties of 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine?
1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine has a molecular weight of 225.38 g/mol, XLogP of 3.28, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclobutyl)-N-methyloct-7-en-1-amine is sourced from PubChem (CID 107009678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).