N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine

C10H20IN — CID 156566247

IUPACN-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine
SMILESCCNCC1CCCC1CCI
InChIInChI=1S/C10H20IN/c1-2-12-8-10-5-3-4-9(10)6-7-11/h9-10,12H,2-8H2,1H3
InChIKeyAVTCGFCRBVMGTI-UHFFFAOYSA-N
MW281.18 g/mol
LogP2.84
Rot. Bonds5

About N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine

N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine (PubChem CID 156566247) has the molecular formula C10H20IN and a molecular weight of 281.18 g/mol. Its IUPAC name is N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine
PubChem CID156566247
Molecular FormulaC10H20IN
Molecular Weight281.18 g/mol
Exact Mass281.06
IUPAC NameN-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine
SMILESCCNCC1CCCC1CCI
InChIInChI=1S/C10H20IN/c1-2-12-8-10-5-3-4-9(10)6-7-11/h9-10,12H,2-8H2,1H3
InChIKeyAVTCGFCRBVMGTI-UHFFFAOYSA-N
XLogP2.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.18
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-[(2-decylcyclohexyl)methyl]ethanamine
CID 81027246
N-[[2-(3-ethylsulfonylpropyl)cyclopentyl]methyl]ethanamine
CID 81034450
N-[[2-(3-methylsulfonylpropyl)cyclopentyl]methyl]ethanamine
CID 81034800
N-[[2-(2-tert-butylsulfonylethyl)cyclopentyl]methyl]ethanamine
CID 106735488
N-[(2-prop-2-enylcyclopentyl)methyl]ethanamine
CID 81034432
N-[[2-[3-(2-methoxyethoxy)propyl]cycloheptyl]methyl]ethanamine
CID 103415943
N-[[2-(2-methylbutyl)cyclohexyl]methyl]ethanamine
CID 81028834
N-[[2-(2-ethylcyclohexyl)cyclohexyl]methyl]ethanamine
CID 81027467
N-[[2-(3,5-dimethylphenyl)cyclopentyl]methyl]ethanamine
CID 81033025
N-[3-[2-(ethylaminomethyl)cyclobutyl]propyl]cyclopropanamine
CID 81005325
N-[(2-pent-4-enylcyclobutyl)methyl]ethanamine
CID 81018015
N-[(2-decylcyclopentyl)methyl]propan-1-amine
CID 81035001

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine?
The IUPAC name of N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine (CID 156566247) is N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine is CCNCC1CCCC1CCI.
What is the InChIKey of N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine?
The InChIKey is AVTCGFCRBVMGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20IN/c1-2-12-8-10-5-3-4-9(10)6-7-11/h9-10,12H,2-8H2,1H3.
What are the key properties of N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine?
N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine has a molecular weight of 281.18 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-iodoethyl)cyclopentyl]methyl]ethanamine is sourced from PubChem (CID 156566247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).