N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine

C8H13N5 — CID 80932571

IUPACN-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine
SMILESNNc1cncc(NCC2CC2)n1
InChIInChI=1S/C8H13N5/c9-13-8-5-10-4-7(12-8)11-3-6-1-2-6/h4-6H,1-3,9H2,(H2,11,12,13)
InChIKeyKDTPAWAYOARVPU-UHFFFAOYSA-N
MW179.23 g/mol
LogP0.58
Rot. Bonds4

About N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine

N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine (PubChem CID 80932571) has the molecular formula C8H13N5 and a molecular weight of 179.23 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine
PubChem CID80932571
Molecular FormulaC8H13N5
Molecular Weight179.23 g/mol
Exact Mass179.12
IUPAC NameN-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine
SMILESNNc1cncc(NCC2CC2)n1
InChIInChI=1S/C8H13N5/c9-13-8-5-10-4-7(12-8)11-3-6-1-2-6/h4-6H,1-3,9H2,(H2,11,12,13)
InChIKeyKDTPAWAYOARVPU-UHFFFAOYSA-N
XLogP0.58
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.23
LogP ≤ 50.58
H-Bond Donors ≤ 53
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-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine?
The IUPAC name of N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine (CID 80932571) is N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine?
The canonical SMILES for N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine is NNc1cncc(NCC2CC2)n1.
What is the InChIKey of N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine?
The InChIKey is KDTPAWAYOARVPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5/c9-13-8-5-10-4-7(12-8)11-3-6-1-2-6/h4-6H,1-3,9H2,(H2,11,12,13).
What are the key properties of N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine?
N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine has a molecular weight of 179.23 g/mol, XLogP of 0.58, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine is sourced from PubChem (CID 80932571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).