N'-cyclobutylmethanimidamide

C5H10N2 — CID 54346963

IUPACN'-cyclobutylmethanimidamide
SMILESN/C=N/C1CCC1
InChIInChI=1S/C5H10N2/c6-4-7-5-2-1-3-5/h4-5H,1-3H2,(H2,6,7)
InChIKeyRNLIJSCSBUVNAN-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.53
Rot. Bonds1

About N'-cyclobutylmethanimidamide

N'-cyclobutylmethanimidamide (PubChem CID 54346963) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is N'-cyclobutylmethanimidamide.

Molecular Properties

Compound NameN'-cyclobutylmethanimidamide
PubChem CID54346963
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC NameN'-cyclobutylmethanimidamide
SMILESN/C=N/C1CCC1
InChIInChI=1S/C5H10N2/c6-4-7-5-2-1-3-5/h4-5H,1-3H2,(H2,6,7)
InChIKeyRNLIJSCSBUVNAN-UHFFFAOYSA-N
XLogP0.53
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.53
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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Frequently Asked Questions

What is the IUPAC name of N'-cyclobutylmethanimidamide?
The IUPAC name of N'-cyclobutylmethanimidamide (CID 54346963) is N'-cyclobutylmethanimidamide.
What is the SMILES notation for N'-cyclobutylmethanimidamide?
The canonical SMILES for N'-cyclobutylmethanimidamide is N/C=N/C1CCC1.
What is the InChIKey of N'-cyclobutylmethanimidamide?
The InChIKey is RNLIJSCSBUVNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c6-4-7-5-2-1-3-5/h4-5H,1-3H2,(H2,6,7).
What are the key properties of N'-cyclobutylmethanimidamide?
N'-cyclobutylmethanimidamide has a molecular weight of 98.15 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclobutylmethanimidamide is sourced from PubChem (CID 54346963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).