N-(3-methylidene-2-pyridinylidene)methanimidamide;propane

C10H15N3 — CID 144881574

IUPACN-(3-methylidene-2-pyridinylidene)methanimidamide;propane
SMILESCCC.[H]/N=C/N=C1\N=CC=CC1=C
InChIInChI=1S/C7H7N3.C3H8/c1-6-3-2-4-9-7(6)10-5-8;1-3-2/h2-5,8H,1H2;3H2,1-2H3/b8-5+,10-7-;
InChIKeyVIMWMNHRYWKZBY-UOJASKDKSA-N
MW177.25 g/mol
LogP2.61
Rot. Bonds1

About N-(3-methylidene-2-pyridinylidene)methanimidamide;propane

N-(3-methylidene-2-pyridinylidene)methanimidamide;propane (PubChem CID 144881574) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-(3-methylidene-2-pyridinylidene)methanimidamide;propane.

Molecular Properties

Compound NameN-(3-methylidene-2-pyridinylidene)methanimidamide;propane
PubChem CID144881574
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-(3-methylidene-2-pyridinylidene)methanimidamide;propane
SMILESCCC.[H]/N=C/N=C1\N=CC=CC1=C
InChIInChI=1S/C7H7N3.C3H8/c1-6-3-2-4-9-7(6)10-5-8;1-3-2/h2-5,8H,1H2;3H2,1-2H3/b8-5+,10-7-;
InChIKeyVIMWMNHRYWKZBY-UOJASKDKSA-N
XLogP2.61
TPSA48.57 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.61
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

2,3-Dihydro-1,8-naphthyridine
CID 53699458
Naphthyridine-diimine
CID 141531040
Carbanide;7,8-dihydropyrido[2,3-b][1,8]naphthyridine;promethium
CID 59491923
3-methylidene-2H-pyridin-6-amine
CID 67442857
(3Z)-3-ethylidene-N-methylpyridin-2-imine
CID 68010675
(3Z)-3-ethylidene-N-[(Z)-3-methylbut-1-enyl]pyridin-2-imine
CID 70306674
3-Methylidenepyridin-2-imine
CID 85854295
(3Z)-3-ethylidenepyridin-2-imine
CID 89254996
3-Methyl-2-methylidenepyrrolo[2,3-b]pyridin-7-ium
CID 90857939
N'-(2-ethylidenehex-3-enyl)propanimidamide
CID 91395600
2H-pyrido[2,3-e][1,4]diazepin-2-amine
CID 91539100
(3Z)-3-[(Z)-pent-3-en-2-ylidene]pyridin-2-imine
CID 117616998

Frequently Asked Questions

What is the IUPAC name of N-(3-methylidene-2-pyridinylidene)methanimidamide;propane?
The IUPAC name of N-(3-methylidene-2-pyridinylidene)methanimidamide;propane (CID 144881574) is N-(3-methylidene-2-pyridinylidene)methanimidamide;propane.
What is the SMILES notation for N-(3-methylidene-2-pyridinylidene)methanimidamide;propane?
The canonical SMILES for N-(3-methylidene-2-pyridinylidene)methanimidamide;propane is CCC.[H]/N=C/N=C1\N=CC=CC1=C.
What is the InChIKey of N-(3-methylidene-2-pyridinylidene)methanimidamide;propane?
The InChIKey is VIMWMNHRYWKZBY-UOJASKDKSA-N. The full InChI is InChI=1S/C7H7N3.C3H8/c1-6-3-2-4-9-7(6)10-5-8;1-3-2/h2-5,8H,1H2;3H2,1-2H3/b8-5+,10-7-;.
What are the key properties of N-(3-methylidene-2-pyridinylidene)methanimidamide;propane?
N-(3-methylidene-2-pyridinylidene)methanimidamide;propane has a molecular weight of 177.25 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylidene-2-pyridinylidene)methanimidamide;propane is sourced from PubChem (CID 144881574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).