N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide

C10H18N6O — CID 103114097

IUPACN-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1cc(NN)ncn1
InChIInChI=1S/C10H18N6O/c1-4-16(3)10(17)7(2)14-8-5-9(15-11)13-6-12-8/h5-7H,4,11H2,1-3H3,(H2,12,13,14,15)
InChIKeyNRYHHPJZKJOPPG-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.04
Rot. Bonds5

About N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide

N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide (PubChem CID 103114097) has the molecular formula C10H18N6O and a molecular weight of 238.29 g/mol. Its IUPAC name is N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide
PubChem CID103114097
Molecular FormulaC10H18N6O
Molecular Weight238.29 g/mol
Exact Mass238.15
IUPAC NameN-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1cc(NN)ncn1
InChIInChI=1S/C10H18N6O/c1-4-16(3)10(17)7(2)14-8-5-9(15-11)13-6-12-8/h5-7H,4,11H2,1-3H3,(H2,12,13,14,15)
InChIKeyNRYHHPJZKJOPPG-UHFFFAOYSA-N
XLogP0.04
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide?
The IUPAC name of N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide (CID 103114097) is N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide.
What is the SMILES notation for N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide?
The canonical SMILES for N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide is CCN(C)C(=O)C(C)Nc1cc(NN)ncn1.
What is the InChIKey of N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide?
The InChIKey is NRYHHPJZKJOPPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O/c1-4-16(3)10(17)7(2)14-8-5-9(15-11)13-6-12-8/h5-7H,4,11H2,1-3H3,(H2,12,13,14,15).
What are the key properties of N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide?
N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide has a molecular weight of 238.29 g/mol, XLogP of 0.04, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide is sourced from PubChem (CID 103114097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).