N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide

C5H10FN3 — CID 170010396

IUPACN-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide
SMILESC/N=C(\NN)C1(F)CC1
InChIInChI=1S/C5H10FN3/c1-8-4(9-7)5(6)2-3-5/h2-3,7H2,1H3,(H,8,9)
InChIKeyBBICCPBZQYTBMS-UHFFFAOYSA-N
MW131.15 g/mol
LogP-0.02
Rot. Bonds1

About N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide

N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide (PubChem CID 170010396) has the molecular formula C5H10FN3 and a molecular weight of 131.15 g/mol. Its IUPAC name is N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide.

Molecular Properties

Compound NameN-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide
PubChem CID170010396
Molecular FormulaC5H10FN3
Molecular Weight131.15 g/mol
Exact Mass131.09
IUPAC NameN-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide
SMILESC/N=C(\NN)C1(F)CC1
InChIInChI=1S/C5H10FN3/c1-8-4(9-7)5(6)2-3-5/h2-3,7H2,1H3,(H,8,9)
InChIKeyBBICCPBZQYTBMS-UHFFFAOYSA-N
XLogP-0.02
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.15
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide?
The IUPAC name of N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide (CID 170010396) is N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide.
What is the SMILES notation for N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide?
The canonical SMILES for N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide is C/N=C(\NN)C1(F)CC1.
What is the InChIKey of N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide?
The InChIKey is BBICCPBZQYTBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN3/c1-8-4(9-7)5(6)2-3-5/h2-3,7H2,1H3,(H,8,9).
What are the key properties of N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide?
N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide has a molecular weight of 131.15 g/mol, XLogP of -0.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-1-fluoro-N'-methylcyclopropane-1-carboximidamide is sourced from PubChem (CID 170010396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).