N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride

C12H24ClN5 — CID 176545255

IUPACN-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(/N/C(=N/[H])N1CCCCC1)N1CCCCC1
InChIInChI=1S/C12H23N5.ClH/c13-11(16-7-3-1-4-8-16)15-12(14)17-9-5-2-6-10-17;/h1-10H2,(H3,13,14,15);1H
InChIKeyIJUSGAHLODTRGD-UHFFFAOYSA-N
MW273.81 g/mol
LogP1.84
Rot. Bonds

About N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride

N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride (PubChem CID 176545255) has the molecular formula C12H24ClN5 and a molecular weight of 273.81 g/mol. Its IUPAC name is N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride.

Molecular Properties

Compound NameN-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride
PubChem CID176545255
Molecular FormulaC12H24ClN5
Molecular Weight273.81 g/mol
Exact Mass273.17
IUPAC NameN-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(/N/C(=N/[H])N1CCCCC1)N1CCCCC1
InChIInChI=1S/C12H23N5.ClH/c13-11(16-7-3-1-4-8-16)15-12(14)17-9-5-2-6-10-17;/h1-10H2,(H3,13,14,15);1H
InChIKeyIJUSGAHLODTRGD-UHFFFAOYSA-N
XLogP1.84
TPSA66.21 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.81
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(N'-methylcarbamimidoyl)piperidine-1-carboximidamide;hydrochloride
CID 176523223
1-(2,6-diethylphenyl)-1-methyl-3-(piperidine-1-carboximidoyl)urea
CID 173447153
ethane;1-piperidin-1-ylethanimine
CID 142132316
N-(N'-cyclohexylcarbamimidoyl)-4,4-difluoropiperidine-1-carboximidamide;hydrochloride
CID 176542819
N-(6-methyl-1,4,5,6-tetrahydropyrimidin-2-yl)piperidine-1-carboximidamide
CID 176545634
pyrrolidine-1-carboximidoyl bromide
CID 14042534
cyclobutyl(piperidin-1-yl)methanimine
CID 64985801
N-[1-(prop-1-en-2-ylamino)ethylidene]azepane-1-carboximidamide
CID 176524920
1,14-di(piperidin-1-yl)tetradecane-1,14-diimine
CID 24740523
(NE)-N-(hydrazinylmethylidene)azepane-1-carboximidamide
CID 176528675
2,2,2-trifluoro-1-pyrrolidin-1-ylethanimine
CID 12864060
N-(morpholine-4-carboximidoyl)butanamide
CID 154044270

Frequently Asked Questions

What is the IUPAC name of N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride?
The IUPAC name of N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride (CID 176545255) is N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride.
What is the SMILES notation for N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride?
The canonical SMILES for N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride is Cl.[H]/N=C(/N/C(=N/[H])N1CCCCC1)N1CCCCC1.
What is the InChIKey of N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride?
The InChIKey is IJUSGAHLODTRGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5.ClH/c13-11(16-7-3-1-4-8-16)15-12(14)17-9-5-2-6-10-17;/h1-10H2,(H3,13,14,15);1H.
What are the key properties of N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride?
N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride has a molecular weight of 273.81 g/mol, XLogP of 1.84, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidine-1-carboximidoyl)piperidine-1-carboximidamide;hydrochloride is sourced from PubChem (CID 176545255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).