N-hexyl-3-methoxycyclobutan-1-amine

C11H23NO — CID 104870767

IUPACN-hexyl-3-methoxycyclobutan-1-amine
SMILESCCCCCCNC1CC(OC)C1
InChIInChI=1S/C11H23NO/c1-3-4-5-6-7-12-10-8-11(9-10)13-2/h10-12H,3-9H2,1-2H3
InChIKeyHVUYMNXPHAGGGA-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.33
Rot. Bonds7

About N-hexyl-3-methoxycyclobutan-1-amine

N-hexyl-3-methoxycyclobutan-1-amine (PubChem CID 104870767) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-hexyl-3-methoxycyclobutan-1-amine.

Molecular Properties

Compound NameN-hexyl-3-methoxycyclobutan-1-amine
PubChem CID104870767
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-hexyl-3-methoxycyclobutan-1-amine
SMILESCCCCCCNC1CC(OC)C1
InChIInChI=1S/C11H23NO/c1-3-4-5-6-7-12-10-8-11(9-10)13-2/h10-12H,3-9H2,1-2H3
InChIKeyHVUYMNXPHAGGGA-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-[(3-methoxycyclobutyl)amino]pentan-1-ol
CID 107316808
N-dodecyl-3-methylcyclobutan-1-amine
CID 113467183
N-hex-5-ynyl-3-methoxycyclobutan-1-amine
CID 104871898
N-heptyl-3,5-dimethylcyclohexan-1-amine
CID 64731854
3-methoxy-N-pent-4-ynylcyclobutan-1-amine
CID 104871850
N-(3,3-dimethylbutyl)-3-methoxycyclobutan-1-amine
CID 104870848
3-methyl-N-octylcyclopentan-1-amine
CID 115566670
3-(4-methoxyphenyl)-N-octylcyclobutan-1-amine
CID 115566490
N-dodecylcyclohexanamine
CID 3679395
1-[(3-methoxycyclobutyl)amino]pentan-3-ol
CID 104871930
N'-cyclopropyl-N-decylpropane-1,3-diamine
CID 113410376
9-methyl-N-octyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 65472549

Frequently Asked Questions

What is the IUPAC name of N-hexyl-3-methoxycyclobutan-1-amine?
The IUPAC name of N-hexyl-3-methoxycyclobutan-1-amine (CID 104870767) is N-hexyl-3-methoxycyclobutan-1-amine.
What is the SMILES notation for N-hexyl-3-methoxycyclobutan-1-amine?
The canonical SMILES for N-hexyl-3-methoxycyclobutan-1-amine is CCCCCCNC1CC(OC)C1.
What is the InChIKey of N-hexyl-3-methoxycyclobutan-1-amine?
The InChIKey is HVUYMNXPHAGGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-4-5-6-7-12-10-8-11(9-10)13-2/h10-12H,3-9H2,1-2H3.
What are the key properties of N-hexyl-3-methoxycyclobutan-1-amine?
N-hexyl-3-methoxycyclobutan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-3-methoxycyclobutan-1-amine is sourced from PubChem (CID 104870767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).