3-methyl-N-(7-methyloctyl)cyclobutan-1-amine

C14H29N — CID 103560965

IUPAC3-methyl-N-(7-methyloctyl)cyclobutan-1-amine
SMILESCC(C)CCCCCCNC1CC(C)C1
InChIInChI=1S/C14H29N/c1-12(2)8-6-4-5-7-9-15-14-10-13(3)11-14/h12-15H,4-11H2,1-3H3
InChIKeyWUPTWISXNSUOJK-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.98
Rot. Bonds8

About 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine

3-methyl-N-(7-methyloctyl)cyclobutan-1-amine (PubChem CID 103560965) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(7-methyloctyl)cyclobutan-1-amine
PubChem CID103560965
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name3-methyl-N-(7-methyloctyl)cyclobutan-1-amine
SMILESCC(C)CCCCCCNC1CC(C)C1
InChIInChI=1S/C14H29N/c1-12(2)8-6-4-5-7-9-15-14-10-13(3)11-14/h12-15H,4-11H2,1-3H3
InChIKeyWUPTWISXNSUOJK-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-dodecyl-3-methylcyclobutan-1-amine
CID 113467183
N-(7-methyloctyl)cyclooctanamine
CID 29032555
N-heptyl-3,5-dimethylcyclohexan-1-amine
CID 64731854
N-(7-methyloctyl)-3-(4-methylphenyl)cyclobutan-1-amine
CID 43634778
4-[(3,5-dimethylcyclohexyl)amino]butan-1-ol
CID 64731694
3-(4-chlorophenyl)-N-(7-methyloctyl)cyclobutan-1-amine
CID 43634782
5-[(3,5-dimethylcyclohexyl)amino]pentanenitrile
CID 64734426
(2R)-4-[[(3S,5S)-3,5-dimethylcyclohexyl]amino]butan-2-ol
CID 96784232
3-(2-fluorophenyl)-N-(7-methyloctyl)cyclobutan-1-amine
CID 43634781
3-(4-bromophenyl)-N-(5-methylhexyl)cyclobutan-1-amine
CID 115325074
3-[[(3R,5S)-3,5-dimethylcyclohexyl]amino]propan-1-ol
CID 96732218
5-[(3,5-dimethylcyclohexyl)amino]pentanoic acid
CID 103254539

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine?
The IUPAC name of 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine (CID 103560965) is 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine.
What is the SMILES notation for 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine?
The canonical SMILES for 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine is CC(C)CCCCCCNC1CC(C)C1.
What is the InChIKey of 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine?
The InChIKey is WUPTWISXNSUOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-12(2)8-6-4-5-7-9-15-14-10-13(3)11-14/h12-15H,4-11H2,1-3H3.
What are the key properties of 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine?
3-methyl-N-(7-methyloctyl)cyclobutan-1-amine has a molecular weight of 211.39 g/mol, XLogP of 3.98, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(7-methyloctyl)cyclobutan-1-amine is sourced from PubChem (CID 103560965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).