1-cyclobutyl-N,3-diethylheptan-1-amine

C15H31N — CID 64987044

IUPAC1-cyclobutyl-N,3-diethylheptan-1-amine
SMILESCCCCC(CC)CC(NCC)C1CCC1
InChIInChI=1S/C15H31N/c1-4-7-9-13(5-2)12-15(16-6-3)14-10-8-11-14/h13-16H,4-12H2,1-3H3
InChIKeyHJZBSUGTOMXOPZ-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds9

About 1-cyclobutyl-N,3-diethylheptan-1-amine

1-cyclobutyl-N,3-diethylheptan-1-amine (PubChem CID 64987044) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-cyclobutyl-N,3-diethylheptan-1-amine.

Molecular Properties

Compound Name1-cyclobutyl-N,3-diethylheptan-1-amine
PubChem CID64987044
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-cyclobutyl-N,3-diethylheptan-1-amine
SMILESCCCCC(CC)CC(NCC)C1CCC1
InChIInChI=1S/C15H31N/c1-4-7-9-13(5-2)12-15(16-6-3)14-10-8-11-14/h13-16H,4-12H2,1-3H3
InChIKeyHJZBSUGTOMXOPZ-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4,4-difluorocyclohexyl)-N,3-diethylheptan-1-amine
CID 105102951
1-cyclopropyl-3-ethyl-N-propylheptan-1-amine
CID 63413488
1-(2,2-dimethylcyclopentyl)-N,3-diethylheptan-1-amine
CID 107187925
1-cyclobutyl-N-ethylundecan-1-amine
CID 64986983
N-(1-cyclohexylpropyl)-2-ethylhexan-1-amine
CID 63492618
[3-ethyl-1-(4-methylcyclohexyl)heptyl]hydrazine
CID 105210540
2-cyclopropyl-N,5-diethylnonan-3-amine
CID 115806059
1-(4,4-dimethylcyclohexyl)-3-ethyl-N-methylheptan-1-amine
CID 65391623
3-ethyl-1-(4-ethylcyclohexyl)-N-methylheptan-1-amine
CID 65392509
3-ethyl-N-methyl-1-(2-methylcyclopentyl)heptan-1-amine
CID 107187935
1-cyclohexyl-N-ethyloctan-1-amine
CID 63413572
1-cyclooctyl-N-ethylheptan-1-amine
CID 80603132

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N,3-diethylheptan-1-amine?
The IUPAC name of 1-cyclobutyl-N,3-diethylheptan-1-amine (CID 64987044) is 1-cyclobutyl-N,3-diethylheptan-1-amine.
What is the SMILES notation for 1-cyclobutyl-N,3-diethylheptan-1-amine?
The canonical SMILES for 1-cyclobutyl-N,3-diethylheptan-1-amine is CCCCC(CC)CC(NCC)C1CCC1.
What is the InChIKey of 1-cyclobutyl-N,3-diethylheptan-1-amine?
The InChIKey is HJZBSUGTOMXOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-7-9-13(5-2)12-15(16-6-3)14-10-8-11-14/h13-16H,4-12H2,1-3H3.
What are the key properties of 1-cyclobutyl-N,3-diethylheptan-1-amine?
1-cyclobutyl-N,3-diethylheptan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.37, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N,3-diethylheptan-1-amine is sourced from PubChem (CID 64987044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).