1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine

C16H33N — CID 114200352

IUPAC1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine
SMILESCCNC(CCC(C)CC(C)C)C1CCCC1
InChIInChI=1S/C16H33N/c1-5-17-16(15-8-6-7-9-15)11-10-14(4)12-13(2)3/h13-17H,5-12H2,1-4H3
InChIKeyDPAJWNZNOAOXGF-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.62
Rot. Bonds8

About 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine

1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine (PubChem CID 114200352) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine
PubChem CID114200352
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC Name1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine
SMILESCCNC(CCC(C)CC(C)C)C1CCCC1
InChIInChI=1S/C16H33N/c1-5-17-16(15-8-6-7-9-15)11-10-14(4)12-13(2)3/h13-17H,5-12H2,1-4H3
InChIKeyDPAJWNZNOAOXGF-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cycloheptyl-N-ethyl-3-methylpentan-1-amine
CID 65399965
1-cyclopentyl-N-ethyl-4,4,4-trifluorobutan-1-amine
CID 64565156
1-cyclopentyl-N-ethyl-N'-methyl-N'-(4-methylpentan-2-yl)ethane-1,2-diamine
CID 104745467
1-cyclopentyl-N-ethyl-3,4,4-trimethylpentan-1-amine
CID 115778397
N-ethyl-1-(4-ethylcyclohexyl)-3-methylbutan-1-amine
CID 64776246
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
1-cycloheptyl-N-ethyl-3,5,5-trimethylhexan-1-amine
CID 105027808
1-cyclopentyl-N-ethyl-2-(2-methylpropylsulfonyl)ethanamine
CID 104753963
1-cyclooctyl-3-methyl-N-propylbutan-1-amine
CID 80611346
1-cyclohexyl-N-ethyloctan-1-amine
CID 63413572
1-cyclooctyl-N-ethylheptan-1-amine
CID 80603132
1-cyclohexyl-N-ethyldodecan-1-amine
CID 114981553

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine?
The IUPAC name of 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine (CID 114200352) is 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine is CCNC(CCC(C)CC(C)C)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine?
The InChIKey is DPAJWNZNOAOXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-5-17-16(15-8-6-7-9-15)11-10-14(4)12-13(2)3/h13-17H,5-12H2,1-4H3.
What are the key properties of 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine?
1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine has a molecular weight of 239.45 g/mol, XLogP of 4.62, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-4,6-dimethylheptan-1-amine is sourced from PubChem (CID 114200352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).