(NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide

C10H17N3O — CID 144779448

IUPAC(NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide
SMILESCC/C=N\C(=N/CC)N1CCCC1=O
InChIInChI=1S/C10H17N3O/c1-3-7-12-10(11-4-2)13-8-5-6-9(13)14/h7H,3-6,8H2,1-2H3/b11-10+,12-7-
InChIKeyARMLRDOOCJUAJA-RFWXHOBXSA-N
MW195.27 g/mol
LogP1.47
Rot. Bonds2

About (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide

(NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide (PubChem CID 144779448) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide.

Molecular Properties

Compound Name(NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide
PubChem CID144779448
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name(NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide
SMILESCC/C=N\C(=N/CC)N1CCCC1=O
InChIInChI=1S/C10H17N3O/c1-3-7-12-10(11-4-2)13-8-5-6-9(13)14/h7H,3-6,8H2,1-2H3/b11-10+,12-7-
InChIKeyARMLRDOOCJUAJA-RFWXHOBXSA-N
XLogP1.47
TPSA45.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.47
H-Bond Donors ≤ 50
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

1-[(2E,5Z)-octa-2,5-dien-3-yl]pyrrolidin-2-one
CID 143497562
N-methyl-2-oxopyrrolidine-1-carboxamide
CID 18176273
(NE)-N-(dimethylaminomethylidene)-2-oxopyrrolidine-1-carboxamide;2-oxopyrrolidine-1-carboxamide
CID 13348355
propyl 2-oxopyrrolidine-1-carboxylate
CID 54526452
3-ethylpentan-3-yl 2-oxopyrrolidine-1-carboxylate
CID 59148760
1-acetylazonan-2-one
CID 19035113
1-[(E)-1-iodooct-1-enyl]pyrrolidin-2-one
CID 134921298
1-decanoylpyrrolidin-2-one
CID 11021000
2-oxopyrrolidine-1-carboxylic acid;zinc
CID 174972169
1-acetylazepan-2-one;methane
CID 158348937
1-(2-aminoacetyl)pyrrolidin-2-one
CID 55208573
1-[(E)-1-bromooct-1-enyl]pyrrolidin-2-one
CID 134988277

Frequently Asked Questions

What is the IUPAC name of (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide?
The IUPAC name of (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide (CID 144779448) is (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide.
What is the SMILES notation for (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide?
The canonical SMILES for (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide is CC/C=N\C(=N/CC)N1CCCC1=O.
What is the InChIKey of (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide?
The InChIKey is ARMLRDOOCJUAJA-RFWXHOBXSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-7-12-10(11-4-2)13-8-5-6-9(13)14/h7H,3-6,8H2,1-2H3/b11-10+,12-7-.
What are the key properties of (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide?
(NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide has a molecular weight of 195.27 g/mol, XLogP of 1.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N'-ethyl-2-oxo-N-propylidenepyrrolidine-1-carboximidamide is sourced from PubChem (CID 144779448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).