N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine

C11H21N5 — CID 103060692

IUPACN-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine
SMILESCC(C)CCN(C)Cc1cnc(NN)cn1
InChIInChI=1S/C11H21N5/c1-9(2)4-5-16(3)8-10-6-14-11(15-12)7-13-10/h6-7,9H,4-5,8,12H2,1-3H3,(H,14,15)
InChIKeyOZZWBPCWOGRLRL-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.24
Rot. Bonds6

About N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine

N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine (PubChem CID 103060692) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine.

Molecular Properties

Compound NameN-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine
PubChem CID103060692
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC NameN-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine
SMILESCC(C)CCN(C)Cc1cnc(NN)cn1
InChIInChI=1S/C11H21N5/c1-9(2)4-5-16(3)8-10-6-14-11(15-12)7-13-10/h6-7,9H,4-5,8,12H2,1-3H3,(H,14,15)
InChIKeyOZZWBPCWOGRLRL-UHFFFAOYSA-N
XLogP1.24
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.24
H-Bond Donors ≤ 52
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 N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine?
The IUPAC name of N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine (CID 103060692) is N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine.
What is the SMILES notation for N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine?
The canonical SMILES for N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine is CC(C)CCN(C)Cc1cnc(NN)cn1.
What is the InChIKey of N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine?
The InChIKey is OZZWBPCWOGRLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-9(2)4-5-16(3)8-10-6-14-11(15-12)7-13-10/h6-7,9H,4-5,8,12H2,1-3H3,(H,14,15).
What are the key properties of N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine?
N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-hydrazinylpyrazin-2-yl)methyl]-N,3-dimethylbutan-1-amine is sourced from PubChem (CID 103060692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).