1-cyclobutyl-N,3-diethylheptan-2-amine

C15H31N — CID 115863541

IUPAC1-cyclobutyl-N,3-diethylheptan-2-amine
SMILESCCCCC(CC)C(CC1CCC1)NCC
InChIInChI=1S/C15H31N/c1-4-7-11-14(5-2)15(16-6-3)12-13-9-8-10-13/h13-16H,4-12H2,1-3H3
InChIKeyYEXGKGOUHHYVCD-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds9

About 1-cyclobutyl-N,3-diethylheptan-2-amine

1-cyclobutyl-N,3-diethylheptan-2-amine (PubChem CID 115863541) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-cyclobutyl-N,3-diethylheptan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-N,3-diethylheptan-2-amine
PubChem CID115863541
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-cyclobutyl-N,3-diethylheptan-2-amine
SMILESCCCCC(CC)C(CC1CCC1)NCC
InChIInChI=1S/C15H31N/c1-4-7-11-14(5-2)15(16-6-3)12-13-9-8-10-13/h13-16H,4-12H2,1-3H3
InChIKeyYEXGKGOUHHYVCD-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-cyclopentyl-N,4-diethyloctan-3-amine
CID 114193299
1-cyclopropyl-N-ethyl-3-propylhexan-2-amine
CID 104986528
N,5-diethylnonan-4-amine
CID 83051951
N,5-diethylpentadecan-6-amine
CID 115831438
1-cyclohexyl-3-ethyl-N-propylpentan-2-amine
CID 115842226
1-cyclohexyl-N-ethyl-3-methylhexan-2-amine
CID 115842188
1-cyclopropyl-3-ethylheptan-2-ol
CID 115804014
1-cyclohexyl-N-ethylheptan-2-amine
CID 115837188
(1-cyclopropyl-2-ethylhexyl)hydrazine
CID 105314540
1-cyclohexyl-3-ethoxy-N-ethylpentan-2-amine
CID 116717017
1-cyclobutyl-N,3-diethylheptan-1-amine
CID 64987044
1-cyclobutyl-3-cyclopentyl-N-ethylpropan-2-amine
CID 115863503

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N,3-diethylheptan-2-amine?
The IUPAC name of 1-cyclobutyl-N,3-diethylheptan-2-amine (CID 115863541) is 1-cyclobutyl-N,3-diethylheptan-2-amine.
What is the SMILES notation for 1-cyclobutyl-N,3-diethylheptan-2-amine?
The canonical SMILES for 1-cyclobutyl-N,3-diethylheptan-2-amine is CCCCC(CC)C(CC1CCC1)NCC.
What is the InChIKey of 1-cyclobutyl-N,3-diethylheptan-2-amine?
The InChIKey is YEXGKGOUHHYVCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-7-11-14(5-2)15(16-6-3)12-13-9-8-10-13/h13-16H,4-12H2,1-3H3.
What are the key properties of 1-cyclobutyl-N,3-diethylheptan-2-amine?
1-cyclobutyl-N,3-diethylheptan-2-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-2-amine is sourced from PubChem (CID 115863541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).