3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol

C10H19N5O — CID 103061212

IUPAC3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol
SMILESCCN(CCCO)Cc1cnc(NN)cn1
InChIInChI=1S/C10H19N5O/c1-2-15(4-3-5-16)8-9-6-13-10(14-11)7-12-9/h6-7,16H,2-5,8,11H2,1H3,(H,13,14)
InChIKeyHGODHUJWJQIPTJ-UHFFFAOYSA-N
MW225.30 g/mol
LogP-0.03
Rot. Bonds7

About 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol

3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol (PubChem CID 103061212) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol.

Molecular Properties

Compound Name3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol
PubChem CID103061212
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol
SMILESCCN(CCCO)Cc1cnc(NN)cn1
InChIInChI=1S/C10H19N5O/c1-2-15(4-3-5-16)8-9-6-13-10(14-11)7-12-9/h6-7,16H,2-5,8,11H2,1H3,(H,13,14)
InChIKeyHGODHUJWJQIPTJ-UHFFFAOYSA-N
XLogP-0.03
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 5-0.03
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 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol?
The IUPAC name of 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol (CID 103061212) is 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol.
What is the SMILES notation for 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol?
The canonical SMILES for 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol is CCN(CCCO)Cc1cnc(NN)cn1.
What is the InChIKey of 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol?
The InChIKey is HGODHUJWJQIPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-2-15(4-3-5-16)8-9-6-13-10(14-11)7-12-9/h6-7,16H,2-5,8,11H2,1H3,(H,13,14).
What are the key properties of 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol?
3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol has a molecular weight of 225.30 g/mol, XLogP of -0.03, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol is sourced from PubChem (CID 103061212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).