(NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide

C19H22N4 — CID 23459662

IUPAC(NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide
SMILESN/C(=N\C(=N\c1ccccc1)N1CCCCC1)c1ccccc1
InChIInChI=1S/C19H22N4/c20-18(16-10-4-1-5-11-16)22-19(23-14-8-3-9-15-23)21-17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H2,20,21,22)
InChIKeyZFORCLGNKREUIM-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.57
Rot. Bonds2

About (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide

(NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide (PubChem CID 23459662) has the molecular formula C19H22N4 and a molecular weight of 306.41 g/mol. Its IUPAC name is (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide.

Molecular Properties

Compound Name(NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide
PubChem CID23459662
Molecular FormulaC19H22N4
Molecular Weight306.41 g/mol
Exact Mass306.18
IUPAC Name(NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide
SMILESN/C(=N\C(=N\c1ccccc1)N1CCCCC1)c1ccccc1
InChIInChI=1S/C19H22N4/c20-18(16-10-4-1-5-11-16)22-19(23-14-8-3-9-15-23)21-17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H2,20,21,22)
InChIKeyZFORCLGNKREUIM-UHFFFAOYSA-N
XLogP3.57
TPSA53.98 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

(NE)-N-[amino(phenyl)methylidene]-4-methyl-N'-phenylpiperazine-1-carboximidamide
CID 23459648
(NE)-N-[amino(phenyl)methylidene]-4-methyl-N'-phenylpiperazine-1-carboximidamide;hydrochloride
CID 23459647
(NZ)-N-[amino(phenyl)methylidene]-N'-phenylthiomorpholine-4-carboximidamide;hydrochloride
CID 23459671
N-[anilino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide
CID 54284526
N-[amino(phenyl)methylidene]-N'-(4-chlorophenyl)morpholine-4-carboximidamide
CID 70567672
N-[(4-methoxyanilino)-phenylmethylidene]-N'-phenylazepane-1-carboximidamide
CID 54036187
N-amino-N'-phenylazocane-1-carboximidamide
CID 116513037
N-[amino(naphthalen-1-yl)methylidene]-N'-phenylmorpholine-4-carboximidamide
CID 70532858
(NZ)-N-[amino-(2-methoxyphenyl)methylidene]-N'-phenylmorpholine-4-carboximidamide
CID 23459640
N'-aminobenzenecarboximidamide
CID 5474957
(NZ)-N-[(2,6-difluorophenyl)-(4-fluoroanilino)methylidene]-N'-phenylazepane-1-carboximidamide
CID 87976890
(NZ)-N-[anilino-(2-methylphenyl)methylidene]-N'-phenylpyrrolidine-1-carboximidamide
CID 22388670

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide?
The IUPAC name of (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide (CID 23459662) is (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide.
What is the SMILES notation for (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide?
The canonical SMILES for (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide is N/C(=N\C(=N\c1ccccc1)N1CCCCC1)c1ccccc1.
What is the InChIKey of (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide?
The InChIKey is ZFORCLGNKREUIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4/c20-18(16-10-4-1-5-11-16)22-19(23-14-8-3-9-15-23)21-17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H2,20,21,22).
What are the key properties of (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide?
(NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide has a molecular weight of 306.41 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[amino(phenyl)methylidene]-N'-phenylpiperidine-1-carboximidamide is sourced from PubChem (CID 23459662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).