(6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide

C11H21IN2 — CID 140972582

IUPAC(6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide
SMILESI.[H]/N=C/CCCC/C=C1/CCCCN1
InChIInChI=1S/C11H20N2.HI/c12-9-5-2-1-3-7-11-8-4-6-10-13-11;/h7,9,12-13H,1-6,8,10H2;1H/b11-7-,12-9+;
InChIKeySQQCCSGGRRCUCA-UOENDVGVSA-N
MW308.21 g/mol
LogP3.47
Rot. Bonds5

About (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide

(6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide (PubChem CID 140972582) has the molecular formula C11H21IN2 and a molecular weight of 308.21 g/mol. Its IUPAC name is (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide.

Molecular Properties

Compound Name(6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide
PubChem CID140972582
Molecular FormulaC11H21IN2
Molecular Weight308.21 g/mol
Exact Mass308.07
IUPAC Name(6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide
SMILESI.[H]/N=C/CCCC/C=C1/CCCCN1
InChIInChI=1S/C11H20N2.HI/c12-9-5-2-1-3-7-11-8-4-6-10-13-11;/h7,9,12-13H,1-6,8,10H2;1H/b11-7-,12-9+;
InChIKeySQQCCSGGRRCUCA-UOENDVGVSA-N
XLogP3.47
TPSA35.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-[2-(3H-pyrrol-5-yl)ethyl]piperazine
CID 20641669
N-[2-(cyclohexen-1-ylimino)ethyl]cyclohexanamine
CID 54273635
4-(3H-pyrrol-5-ylmethyl)piperidine
CID 54520917
6-Piperidin-3-yl-3,4-dihydropyridine
CID 90103419
ethane;2-[2-(3H-pyrrol-5-yl)ethyl]piperazine
CID 90763652
2-(cyclohexen-1-ylimino)-N-ethylethanamine
CID 123650187
N-(1-prop-1-en-2-yliminobutan-2-yl)cyclohex-3-en-1-amine
CID 138549377
(5E)-5-(1-methylpiperidin-2-ylidene)pentan-1-imine;hydroiodide
CID 140972577
(6E)-6-(1-methylpiperidin-2-ylidene)hexan-1-imine;hydroiodide
CID 140972589
6-Piperidin-4-yl-3,4-dihydropyridine
CID 142892723
2-(1,2,3,4-Tetrahydropyridin-6-yl)-2,3,4,5-tetrahydropyridine
CID 144329213
5-ethyl-3H-pyrrole;methane;molecular hydrogen;1-piperidin-2-ylethenamine
CID 144920999

Frequently Asked Questions

What is the IUPAC name of (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide?
The IUPAC name of (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide (CID 140972582) is (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide.
What is the SMILES notation for (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide?
The canonical SMILES for (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide is I.[H]/N=C/CCCC/C=C1/CCCCN1.
What is the InChIKey of (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide?
The InChIKey is SQQCCSGGRRCUCA-UOENDVGVSA-N. The full InChI is InChI=1S/C11H20N2.HI/c12-9-5-2-1-3-7-11-8-4-6-10-13-11;/h7,9,12-13H,1-6,8,10H2;1H/b11-7-,12-9+;.
What are the key properties of (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide?
(6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide has a molecular weight of 308.21 g/mol, XLogP of 3.47, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-piperidin-2-ylidenehexan-1-imine;hydroiodide is sourced from PubChem (CID 140972582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).