carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)

C14H30FeIN — CID 162293255

IUPACcarbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)
SMILESC1CCCC1.CN(C)C1CCCC1I.[CH3-].[CH3-].[Fe+2]
InChIInChI=1S/C7H14IN.C5H10.2CH3.Fe/c1-9(2)7-5-3-4-6(7)8;1-2-4-5-3-1;;;/h6-7H,3-5H2,1-2H3;1-5H2;2*1H3;/q;;2*-1;+2
InChIKeyNVEZIXRDKAPUNN-UHFFFAOYSA-N
MW395.15 g/mol
LogP4.75
Rot. Bonds1

About carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)

carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+) (PubChem CID 162293255) has the molecular formula C14H30FeIN and a molecular weight of 395.15 g/mol. Its IUPAC name is carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+).

Molecular Properties

Compound Namecarbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)
PubChem CID162293255
Molecular FormulaC14H30FeIN
Molecular Weight395.15 g/mol
Exact Mass395.08
IUPAC Namecarbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)
SMILESC1CCCC1.CN(C)C1CCCC1I.[CH3-].[CH3-].[Fe+2]
InChIInChI=1S/C7H14IN.C5H10.2CH3.Fe/c1-9(2)7-5-3-4-6(7)8;1-2-4-5-3-1;;;/h6-7H,3-5H2,1-2H3;1-5H2;2*1H3;/q;;2*-1;+2
InChIKeyNVEZIXRDKAPUNN-UHFFFAOYSA-N
XLogP4.75
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.15
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+) with MolForge

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Related Compounds

(2-iodocyclododecyl)-methylcarbamic acid
CID 71431982
N,N,2-trimethylcyclopentan-1-amine
CID 23553747
cis-(1S,2R)-1-N,1-N-dimethylcyclopentane-1,2-diamine
CID 55281587
(2S)-2-fluoro-N,N-dimethylcyclopentan-1-amine
CID 158852291
trans-(1S,2S)-2-methoxy-N,N-dimethylcyclopentan-1-amine
CID 129113118
(2R)-3-(dimethylamino)cyclohexane-1,2-diol;3-(dimethylamino)cyclohexane-1,2-diol
CID 157254014
1,3-diiodo-2-methylcyclohexane
CID 146238386
trans-(1S,2R)-2-(dimethylamino)cyclopentane-1-carbaldehyde
CID 59356674
(6aR)-N,N-dimethyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-amine
CID 158892420
2-(dimethylamino)cycloheptane-1-carbonitrile
CID 43291764
trans-(1S,2S)-2-N,2-N-dimethylcyclohexane-1,2-diamine;dihydrochloride
CID 46941649
trans-(1S,2S)-2-N-tert-butyl-1-N,1-N-dimethylcyclopentane-1,2-diamine
CID 134429389

Frequently Asked Questions

What is the IUPAC name of carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)?
The IUPAC name of carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+) (CID 162293255) is carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+).
What is the SMILES notation for carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)?
The canonical SMILES for carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+) is C1CCCC1.CN(C)C1CCCC1I.[CH3-].[CH3-].[Fe+2].
What is the InChIKey of carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)?
The InChIKey is NVEZIXRDKAPUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14IN.C5H10.2CH3.Fe/c1-9(2)7-5-3-4-6(7)8;1-2-4-5-3-1;;;/h6-7H,3-5H2,1-2H3;1-5H2;2*1H3;/q;;2*-1;+2.
What are the key properties of carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+)?
carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+) has a molecular weight of 395.15 g/mol, XLogP of 4.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;cyclopentane;2-iodo-N,N-dimethylcyclopentan-1-amine;iron(2+) is sourced from PubChem (CID 162293255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).