N'-hex-5-enylpiperidine-1-carboximidamide

C12H23N3 — CID 100611002

IUPACN'-hex-5-enylpiperidine-1-carboximidamide
SMILESC=CCCCC/N=C(\N)N1CCCCC1
InChIInChI=1S/C12H23N3/c1-2-3-4-6-9-14-12(13)15-10-7-5-8-11-15/h2H,1,3-11H2,(H2,13,14)
InChIKeyIHXWDFQDBGNXKZ-UHFFFAOYSA-N
MW209.34 g/mol
LogP2.14
Rot. Bonds5

About N'-hex-5-enylpiperidine-1-carboximidamide

N'-hex-5-enylpiperidine-1-carboximidamide (PubChem CID 100611002) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is N'-hex-5-enylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-hex-5-enylpiperidine-1-carboximidamide
PubChem CID100611002
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC NameN'-hex-5-enylpiperidine-1-carboximidamide
SMILESC=CCCCC/N=C(\N)N1CCCCC1
InChIInChI=1S/C12H23N3/c1-2-3-4-6-9-14-12(13)15-10-7-5-8-11-15/h2H,1,3-11H2,(H2,13,14)
InChIKeyIHXWDFQDBGNXKZ-UHFFFAOYSA-N
XLogP2.14
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,2-Dimethyl-1-pent-4-enyl-3-(2-piperidin-1-ylethyl)guanidine
CID 109497702
1,2-Dimethyl-1-pent-4-enyl-3-(5-piperidin-1-ylpentyl)guanidine
CID 109499534
3-Ethyl-1-methyl-1-pent-4-enyl-2-(5-piperidin-1-ylpentyl)guanidine
CID 109499536
N'-hex-5-enylpiperidine-1-carboximidamide;hydroiodide
CID 121520033
N'-(2,2-dimethylpent-4-enyl)-3-methylpiperidine-1-carboximidamide
CID 122096308

Frequently Asked Questions

What is the IUPAC name of N'-hex-5-enylpiperidine-1-carboximidamide?
The IUPAC name of N'-hex-5-enylpiperidine-1-carboximidamide (CID 100611002) is N'-hex-5-enylpiperidine-1-carboximidamide.
What is the SMILES notation for N'-hex-5-enylpiperidine-1-carboximidamide?
The canonical SMILES for N'-hex-5-enylpiperidine-1-carboximidamide is C=CCCCC/N=C(\N)N1CCCCC1.
What is the InChIKey of N'-hex-5-enylpiperidine-1-carboximidamide?
The InChIKey is IHXWDFQDBGNXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-2-3-4-6-9-14-12(13)15-10-7-5-8-11-15/h2H,1,3-11H2,(H2,13,14).
What are the key properties of N'-hex-5-enylpiperidine-1-carboximidamide?
N'-hex-5-enylpiperidine-1-carboximidamide has a molecular weight of 209.34 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hex-5-enylpiperidine-1-carboximidamide is sourced from PubChem (CID 100611002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).