N-ethenyl-N'-propylethanimidamide

C7H14N2 — CID 123737533

IUPACN-ethenyl-N'-propylethanimidamide
SMILESC=CN/C(C)=N/CCC
InChIInChI=1S/C7H14N2/c1-4-6-9-7(3)8-5-2/h5H,2,4,6H2,1,3H3,(H,8,9)
InChIKeyPFIPGCYIVWUSPS-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.55
Rot. Bonds3

About N-ethenyl-N'-propylethanimidamide

N-ethenyl-N'-propylethanimidamide (PubChem CID 123737533) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-ethenyl-N'-propylethanimidamide.

Molecular Properties

Compound NameN-ethenyl-N'-propylethanimidamide
PubChem CID123737533
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-ethenyl-N'-propylethanimidamide
SMILESC=CN/C(C)=N/CCC
InChIInChI=1S/C7H14N2/c1-4-6-9-7(3)8-5-2/h5H,2,4,6H2,1,3H3,(H,8,9)
InChIKeyPFIPGCYIVWUSPS-UHFFFAOYSA-N
XLogP1.55
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.55
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

N,N'-dipropylethanimidamide
CID 12021308
N-ethenyl-N'-iodoethanimidamide
CID 154530145
N-ethenyl-2-[methyl-[2-(methylamino)ethyl]amino]-N'-propylethanimidamide
CID 118970815
N-ethenyl-N'-ethylprop-2-enimidamide;molecular hydrogen
CID 143656468
N-propylpent-3-en-2-imine
CID 123895305
ethane;N'-propylethanimidamide
CID 156797871
2-methyl-N-propylhex-1-en-3-imine
CID 123390647
N'-[(1Z,3E)-2,3-dimethylhexa-1,3,5-trienyl]-N-ethenylethanimidamide
CID 134214435
prop-2-enyl N'-propylcarbamimidothioate;hydrochloride
CID 130978662
lithium 4-propyliminopent-2-en-2-olate
CID 178130174
ethene;methane;2-propyl-1-(N'-propylcarbamimidoyl)guanidine;vanadium
CID 158727971
1,1-diethyl-3-prop-1-enyl-2-propylguanidine
CID 141286061

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-propylethanimidamide?
The IUPAC name of N-ethenyl-N'-propylethanimidamide (CID 123737533) is N-ethenyl-N'-propylethanimidamide.
What is the SMILES notation for N-ethenyl-N'-propylethanimidamide?
The canonical SMILES for N-ethenyl-N'-propylethanimidamide is C=CN/C(C)=N/CCC.
What is the InChIKey of N-ethenyl-N'-propylethanimidamide?
The InChIKey is PFIPGCYIVWUSPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-4-6-9-7(3)8-5-2/h5H,2,4,6H2,1,3H3,(H,8,9).
What are the key properties of N-ethenyl-N'-propylethanimidamide?
N-ethenyl-N'-propylethanimidamide has a molecular weight of 126.20 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-propylethanimidamide is sourced from PubChem (CID 123737533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).