5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine

C15H27N — CID 143587043

IUPAC5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine
SMILESC=CC(=C)C(CCCCNC)CC1CCC1
InChIInChI=1S/C15H27N/c1-4-13(2)15(10-5-6-11-16-3)12-14-8-7-9-14/h4,14-16H,1-2,5-12H2,3H3
InChIKeyFPCATRCZZHTDPM-UHFFFAOYSA-N
MW221.39 g/mol
LogP3.92
Rot. Bonds9

About 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine

5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine (PubChem CID 143587043) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine.

Molecular Properties

Compound Name5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine
PubChem CID143587043
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine
SMILESC=CC(=C)C(CCCCNC)CC1CCC1
InChIInChI=1S/C15H27N/c1-4-13(2)15(10-5-6-11-16-3)12-14-8-7-9-14/h4,14-16H,1-2,5-12H2,3H3
InChIKeyFPCATRCZZHTDPM-UHFFFAOYSA-N
XLogP3.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,5-dimethyl-6-methylideneoct-7-en-1-amine
CID 143352180
N-butyl-2-[2-[5-(cyclopropylmethyl)-6-methylideneoct-7-enyl]hydrazinyl]-N-methylprop-2-enamide
CID 143358708
2-(cyclobutylmethyl)-N-methylhexanamide
CID 89102892
2-prop-1-en-2-ylpentylcyclobutane
CID 123471153
5-ethyl-N,7,7-trimethyl-6-methylideneoctan-1-amine
CID 155468092
2-(cyclopentylmethyl)-N-methylhexanamide
CID 70921101
6-cyclohexyl-6-iodo-N-methylhexan-1-amine
CID 167101006
1-cyclobutyl-N-methylnonan-2-amine
CID 115863864
2-(cyclohexylmethyl)-N-[2-(methylamino)ethyl]butanamide;hydrochloride
CID 119500875
1-cycloheptyl-N,6,6-trimethylheptan-2-amine
CID 114211051
3-cyclohexyl-N-methylpropan-1-amine
CID 3028091
3-cyclopentyl-N-methylpropan-1-amine;hydrochloride
CID 75530738

Frequently Asked Questions

What is the IUPAC name of 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine?
The IUPAC name of 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine (CID 143587043) is 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine.
What is the SMILES notation for 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine?
The canonical SMILES for 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine is C=CC(=C)C(CCCCNC)CC1CCC1.
What is the InChIKey of 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine?
The InChIKey is FPCATRCZZHTDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-4-13(2)15(10-5-6-11-16-3)12-14-8-7-9-14/h4,14-16H,1-2,5-12H2,3H3.
What are the key properties of 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine?
5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine has a molecular weight of 221.39 g/mol, XLogP of 3.92, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclobutylmethyl)-N-methyl-6-methylideneoct-7-en-1-amine is sourced from PubChem (CID 143587043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).