N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine

C16H33N — CID 82930165

IUPACN-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine
SMILESCCC(CC)CC1(CNC(C)(C)C)CCCC1
InChIInChI=1S/C16H33N/c1-6-14(7-2)12-16(10-8-9-11-16)13-17-15(3,4)5/h14,17H,6-13H2,1-5H3
InChIKeyZFSIUEJYELFMCG-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.76
Rot. Bonds6

About N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine

N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine (PubChem CID 82930165) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine
PubChem CID82930165
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC NameN-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine
SMILESCCC(CC)CC1(CNC(C)(C)C)CCCC1
InChIInChI=1S/C16H33N/c1-6-14(7-2)12-16(10-8-9-11-16)13-17-15(3,4)5/h14,17H,6-13H2,1-5H3
InChIKeyZFSIUEJYELFMCG-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
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

N-[[1-(2-ethylhexyl)cyclobutyl]methyl]-2-methylpropan-2-amine
CID 65195011
[1-[(tert-butylamino)methyl]cyclopentyl]methanol
CID 154955274
1-[1-(2-ethylbutyl)cyclobutyl]-N-methylmethanamine
CID 82930955
N-[[1-[(tert-butylamino)methyl]cyclohexyl]methyl]-N-methylbutan-2-amine
CID 62262894
N-[[1-(ethoxymethyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 103984495
2-methyl-N-[[1-(2-propan-2-ylsulfonylethyl)cyclobutyl]methyl]propan-2-amine
CID 106730047
N-[[1-[(tert-butylamino)methyl]cyclopentyl]methyl]-N,2-dimethylbutan-2-amine
CID 63964314
2-methyl-N-[(1-nonylcyclobutyl)methyl]propan-2-amine
CID 65194168
N-[[1-[(tert-butylamino)methyl]cyclohexyl]methyl]-N-ethyl-2-methylpropan-1-amine
CID 63482009
[1-(2-ethylbutyl)cyclohexyl]methanol
CID 82934579
1-(bromomethyl)-1-(2-ethylbutyl)cyclohexane
CID 82935181
N-[[1-[(tert-butylamino)methyl]cyclopentyl]methyl]-N-methylbutan-1-amine
CID 55051857

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine (CID 82930165) is N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine is CCC(CC)CC1(CNC(C)(C)C)CCCC1.
What is the InChIKey of N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
The InChIKey is ZFSIUEJYELFMCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-6-14(7-2)12-16(10-8-9-11-16)13-17-15(3,4)5/h14,17H,6-13H2,1-5H3.
What are the key properties of N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine has a molecular weight of 239.45 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-ethylbutyl)cyclopentyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 82930165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).