N-(iodomethoxymethyl)cyclopentanamine;hydrochloride

C7H15ClINO — CID 69185136

IUPACN-(iodomethoxymethyl)cyclopentanamine;hydrochloride
SMILESCl.ICOCNC1CCCC1
InChIInChI=1S/C7H14INO.ClH/c8-5-10-6-9-7-3-1-2-4-7;/h7,9H,1-6H2;1H
InChIKeyMAKAQLVOTIGELG-UHFFFAOYSA-N
MW291.56 g/mol
LogP2.31
Rot. Bonds4

About N-(iodomethoxymethyl)cyclopentanamine;hydrochloride

N-(iodomethoxymethyl)cyclopentanamine;hydrochloride (PubChem CID 69185136) has the molecular formula C7H15ClINO and a molecular weight of 291.56 g/mol. Its IUPAC name is N-(iodomethoxymethyl)cyclopentanamine;hydrochloride.

Molecular Properties

Compound NameN-(iodomethoxymethyl)cyclopentanamine;hydrochloride
PubChem CID69185136
Molecular FormulaC7H15ClINO
Molecular Weight291.56 g/mol
Exact Mass290.99
IUPAC NameN-(iodomethoxymethyl)cyclopentanamine;hydrochloride
SMILESCl.ICOCNC1CCCC1
InChIInChI=1S/C7H14INO.ClH/c8-5-10-6-9-7-3-1-2-4-7;/h7,9H,1-6H2;1H
InChIKeyMAKAQLVOTIGELG-UHFFFAOYSA-N
XLogP2.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.56
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(iodomethyl)cyclopentanamine
CID 126663668
N-(iodomethyl)cyclohexanamine
CID 89271682
N'-cyclopentylethane-1,2-diamine;dihydrochloride
CID 154725501
N-(prop-1-ynoxymethyl)cyclohexanamine
CID 70550699
N-(cyclobutylmethyl)cycloheptanamine
CID 43298514
N,N'-dicyclohexyloctane-1,8-diamine;dihydrochloride
CID 3029604
(cyclobutylamino)methyl cyclohexanecarboxylate
CID 151663957
N-propylcyclohexanamine;hydrochloride
CID 17370003
N-(cyclohexylmethyl)cyclohexanamine;ethene
CID 143308482
N-(cyclobutylmethyl)cyclobutanamine
CID 57306046
N-ethylcyclooctanamine
CID 13112621
N-ethylcyclodecanamine
CID 148546213

Frequently Asked Questions

What is the IUPAC name of N-(iodomethoxymethyl)cyclopentanamine;hydrochloride?
The IUPAC name of N-(iodomethoxymethyl)cyclopentanamine;hydrochloride (CID 69185136) is N-(iodomethoxymethyl)cyclopentanamine;hydrochloride.
What is the SMILES notation for N-(iodomethoxymethyl)cyclopentanamine;hydrochloride?
The canonical SMILES for N-(iodomethoxymethyl)cyclopentanamine;hydrochloride is Cl.ICOCNC1CCCC1.
What is the InChIKey of N-(iodomethoxymethyl)cyclopentanamine;hydrochloride?
The InChIKey is MAKAQLVOTIGELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14INO.ClH/c8-5-10-6-9-7-3-1-2-4-7;/h7,9H,1-6H2;1H.
What are the key properties of N-(iodomethoxymethyl)cyclopentanamine;hydrochloride?
N-(iodomethoxymethyl)cyclopentanamine;hydrochloride has a molecular weight of 291.56 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(iodomethoxymethyl)cyclopentanamine;hydrochloride is sourced from PubChem (CID 69185136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).