2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide

C10H15Cl2N5O — CID 106347643

IUPAC2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide
SMILESCC(C)C(Nc1nc(NN)c(Cl)cc1Cl)C(N)=O
InChIInChI=1S/C10H15Cl2N5O/c1-4(2)7(8(13)18)15-9-5(11)3-6(12)10(16-9)17-14/h3-4,7H,14H2,1-2H3,(H2,13,18)(H2,15,16,17)
InChIKeyNUQRAJQNSTUTNW-UHFFFAOYSA-N
MW292.17 g/mol
LogP1.60
Rot. Bonds5

About 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide

2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide (PubChem CID 106347643) has the molecular formula C10H15Cl2N5O and a molecular weight of 292.17 g/mol. Its IUPAC name is 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide.

Molecular Properties

Compound Name2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide
PubChem CID106347643
Molecular FormulaC10H15Cl2N5O
Molecular Weight292.17 g/mol
Exact Mass291.07
IUPAC Name2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide
SMILESCC(C)C(Nc1nc(NN)c(Cl)cc1Cl)C(N)=O
InChIInChI=1S/C10H15Cl2N5O/c1-4(2)7(8(13)18)15-9-5(11)3-6(12)10(16-9)17-14/h3-4,7H,14H2,1-2H3,(H2,13,18)(H2,15,16,17)
InChIKeyNUQRAJQNSTUTNW-UHFFFAOYSA-N
XLogP1.60
TPSA106.06 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 51.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide?
The IUPAC name of 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide (CID 106347643) is 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide.
What is the SMILES notation for 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide?
The canonical SMILES for 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide is CC(C)C(Nc1nc(NN)c(Cl)cc1Cl)C(N)=O.
What is the InChIKey of 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide?
The InChIKey is NUQRAJQNSTUTNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15Cl2N5O/c1-4(2)7(8(13)18)15-9-5(11)3-6(12)10(16-9)17-14/h3-4,7H,14H2,1-2H3,(H2,13,18)(H2,15,16,17).
What are the key properties of 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide?
2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide has a molecular weight of 292.17 g/mol, XLogP of 1.60, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-3-methylbutanamide is sourced from PubChem (CID 106347643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).