N-(2-aminoethyl)-2-methylprop-2-enamide

C6H12N2O — CID 10154062

IUPACN-(2-aminoethyl)-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCN
InChIInChI=1S/C6H12N2O/c1-5(2)6(9)8-4-3-7/h1,3-4,7H2,2H3,(H,8,9)
InChIKeyRFZRLVGQBIINKQ-UHFFFAOYSA-N
MW128.17 g/mol
LogP-0.36
Rot. Bonds3

About N-(2-aminoethyl)-2-methylprop-2-enamide

N-(2-aminoethyl)-2-methylprop-2-enamide (PubChem CID 10154062) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-methylprop-2-enamide
PubChem CID10154062
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC NameN-(2-aminoethyl)-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCN
InChIInChI=1S/C6H12N2O/c1-5(2)6(9)8-4-3-7/h1,3-4,7H2,2H3,(H,8,9)
InChIKeyRFZRLVGQBIINKQ-UHFFFAOYSA-N
XLogP-0.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-methylprop-2-enamide?
The IUPAC name of N-(2-aminoethyl)-2-methylprop-2-enamide (CID 10154062) is N-(2-aminoethyl)-2-methylprop-2-enamide.
What is the SMILES notation for N-(2-aminoethyl)-2-methylprop-2-enamide?
The canonical SMILES for N-(2-aminoethyl)-2-methylprop-2-enamide is C=C(C)C(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)-2-methylprop-2-enamide?
The InChIKey is RFZRLVGQBIINKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-5(2)6(9)8-4-3-7/h1,3-4,7H2,2H3,(H,8,9).
What are the key properties of N-(2-aminoethyl)-2-methylprop-2-enamide?
N-(2-aminoethyl)-2-methylprop-2-enamide has a molecular weight of 128.17 g/mol, XLogP of -0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-methylprop-2-enamide is sourced from PubChem (CID 10154062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).