1-cyclopentyl-N,5-diethylheptan-3-amine

C16H33N — CID 105028198

IUPAC1-cyclopentyl-N,5-diethylheptan-3-amine
SMILESCCNC(CCC1CCCC1)CC(CC)CC
InChIInChI=1S/C16H33N/c1-4-14(5-2)13-16(17-6-3)12-11-15-9-7-8-10-15/h14-17H,4-13H2,1-3H3
InChIKeyDFEBFXVKYCXZMM-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.76
Rot. Bonds9

About 1-cyclopentyl-N,5-diethylheptan-3-amine

1-cyclopentyl-N,5-diethylheptan-3-amine (PubChem CID 105028198) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is 1-cyclopentyl-N,5-diethylheptan-3-amine.

Molecular Properties

Compound Name1-cyclopentyl-N,5-diethylheptan-3-amine
PubChem CID105028198
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC Name1-cyclopentyl-N,5-diethylheptan-3-amine
SMILESCCNC(CCC1CCCC1)CC(CC)CC
InChIInChI=1S/C16H33N/c1-4-14(5-2)13-16(17-6-3)12-11-15-9-7-8-10-15/h14-17H,4-13H2,1-3H3
InChIKeyDFEBFXVKYCXZMM-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-5-ethyl-N-methylnonan-3-amine
CID 115806235
1-cyclohexyl-5-ethylheptan-3-amine
CID 105028019
1-cyclopentyl-N-ethyloct-7-en-3-amine
CID 104986890
1-cyclopentyl-5-(2,2-difluoroethoxy)-N-ethylpentan-3-amine
CID 114192296
4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine
CID 63526556
3-ethylhexylcyclopentane
CID 123372890
1-cyclopentyl-N,5-dimethylheptan-3-amine
CID 115846256
1,3-dicyclopentyl-N-ethylpropan-2-amine
CID 115847226
3-cycloheptyl-1-cyclopropyl-N-ethylpropan-1-amine
CID 82924608
1-cyclobutyl-3-cyclopentyl-N-ethylpropan-2-amine
CID 115863503
4-cyclohexyl-1-(3,5-difluorophenyl)-N-ethylbutan-2-amine
CID 105412616
1-cyclohexyl-N-propylhexan-3-amine
CID 63400154

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N,5-diethylheptan-3-amine?
The IUPAC name of 1-cyclopentyl-N,5-diethylheptan-3-amine (CID 105028198) is 1-cyclopentyl-N,5-diethylheptan-3-amine.
What is the SMILES notation for 1-cyclopentyl-N,5-diethylheptan-3-amine?
The canonical SMILES for 1-cyclopentyl-N,5-diethylheptan-3-amine is CCNC(CCC1CCCC1)CC(CC)CC.
What is the InChIKey of 1-cyclopentyl-N,5-diethylheptan-3-amine?
The InChIKey is DFEBFXVKYCXZMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-4-14(5-2)13-16(17-6-3)12-11-15-9-7-8-10-15/h14-17H,4-13H2,1-3H3.
What are the key properties of 1-cyclopentyl-N,5-diethylheptan-3-amine?
1-cyclopentyl-N,5-diethylheptan-3-amine has a molecular weight of 239.45 g/mol, XLogP of 4.76, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N,5-diethylheptan-3-amine is sourced from PubChem (CID 105028198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).