N-(2-methylprop-2-enylideneamino)methanamine

C5H10N2 — CID 76750151

IUPACN-(2-methylprop-2-enylideneamino)methanamine
SMILESC=C(C)C=NNC
InChIInChI=1S/C5H10N2/c1-5(2)4-7-6-3/h4,6H,1H2,2-3H3
InChIKeyJTQKPDUJCGDXER-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.77
Rot. Bonds2

About N-(2-methylprop-2-enylideneamino)methanamine

N-(2-methylprop-2-enylideneamino)methanamine (PubChem CID 76750151) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is N-(2-methylprop-2-enylideneamino)methanamine.

Molecular Properties

Compound NameN-(2-methylprop-2-enylideneamino)methanamine
PubChem CID76750151
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC NameN-(2-methylprop-2-enylideneamino)methanamine
SMILESC=C(C)C=NNC
InChIInChI=1S/C5H10N2/c1-5(2)4-7-6-3/h4,6H,1H2,2-3H3
InChIKeyJTQKPDUJCGDXER-UHFFFAOYSA-N
XLogP0.77
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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-(2-methylprop-2-enylideneamino)methanamine?
The IUPAC name of N-(2-methylprop-2-enylideneamino)methanamine (CID 76750151) is N-(2-methylprop-2-enylideneamino)methanamine.
What is the SMILES notation for N-(2-methylprop-2-enylideneamino)methanamine?
The canonical SMILES for N-(2-methylprop-2-enylideneamino)methanamine is C=C(C)C=NNC.
What is the InChIKey of N-(2-methylprop-2-enylideneamino)methanamine?
The InChIKey is JTQKPDUJCGDXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-5(2)4-7-6-3/h4,6H,1H2,2-3H3.
What are the key properties of N-(2-methylprop-2-enylideneamino)methanamine?
N-(2-methylprop-2-enylideneamino)methanamine has a molecular weight of 98.15 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-2-enylideneamino)methanamine is sourced from PubChem (CID 76750151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).