[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium

C7H10N5+ — CID 147378238

IUPAC[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium
SMILESNC(=[NH2+])N=C(N)c1cccnc1
InChIInChI=1S/C7H9N5/c8-6(12-7(9)10)5-2-1-3-11-4-5/h1-4H,(H5,8,9,10,12)/p+1
InChIKeyDKLCYOYZIPHHEH-UHFFFAOYSA-O
MW164.19 g/mol
LogP-2.14
Rot. Bonds1

About [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium

[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium (PubChem CID 147378238) has the molecular formula C7H10N5+ and a molecular weight of 164.19 g/mol. Its IUPAC name is [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium.

Molecular Properties

Compound Name[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium
PubChem CID147378238
Molecular FormulaC7H10N5+
Molecular Weight164.19 g/mol
Exact Mass164.09
IUPAC Name[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium
SMILESNC(=[NH2+])N=C(N)c1cccnc1
InChIInChI=1S/C7H9N5/c8-6(12-7(9)10)5-2-1-3-11-4-5/h1-4H,(H5,8,9,10,12)/p+1
InChIKeyDKLCYOYZIPHHEH-UHFFFAOYSA-O
XLogP-2.14
TPSA102.88 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 5-2.14
H-Bond Donors ≤ 53
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

N'-methoxypyridine-3-carboximidamide
CID 82467799
N'-hydroxypyridine-3-carboximidamide;pyridine-3-carboxylate
CID 22353992
CID 175154223
CID 175154223
methane;pyridine-3-carboxamide
CID 19390506
benzene;pyridine-3-carboxamide
CID 66766032
N'-(2-methoxyethyl)pyridine-3-carboximidamide
CID 63181303
azane;platinum(4+);pyridine-3-carboxamide;dichloride
CID 71548674
N'-(4-methylsulfanylphenyl)pyridine-3-carboximidamide
CID 59700958
[amino(phenyl)methylidene]carbamoyloxymethyl pyridine-3-carboxylate
CID 54280723
oxalic acid;pyridine-3-carboxamide
CID 69110411
3-[(Z)-but-2-en-2-yl]pyridine
CID 101055092
(E)-1-pyridin-3-yl-N-[(E)-1-pyridin-3-ylethylideneamino]ethanimine
CID 5405316

Frequently Asked Questions

What is the IUPAC name of [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium?
The IUPAC name of [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium (CID 147378238) is [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium.
What is the SMILES notation for [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium?
The canonical SMILES for [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium is NC(=[NH2+])N=C(N)c1cccnc1.
What is the InChIKey of [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium?
The InChIKey is DKLCYOYZIPHHEH-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H9N5/c8-6(12-7(9)10)5-2-1-3-11-4-5/h1-4H,(H5,8,9,10,12)/p+1.
What are the key properties of [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium?
[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium has a molecular weight of 164.19 g/mol, XLogP of -2.14, 1 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium is sourced from PubChem (CID 147378238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).