N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide

C11H17N5O — CID 107378190

IUPACN-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide
SMILESCN(CC1CCC1)C(=O)c1cnc(NN)cn1
InChIInChI=1S/C11H17N5O/c1-16(7-8-3-2-4-8)11(17)9-5-14-10(15-12)6-13-9/h5-6,8H,2-4,7,12H2,1H3,(H,14,15)
InChIKeyLWKNIROBAIFLLS-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.63
Rot. Bonds4

About N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide

N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide (PubChem CID 107378190) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide
PubChem CID107378190
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC NameN-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide
SMILESCN(CC1CCC1)C(=O)c1cnc(NN)cn1
InChIInChI=1S/C11H17N5O/c1-16(7-8-3-2-4-8)11(17)9-5-14-10(15-12)6-13-9/h5-6,8H,2-4,7,12H2,1H3,(H,14,15)
InChIKeyLWKNIROBAIFLLS-UHFFFAOYSA-N
XLogP0.63
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.63
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-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide (CID 107378190) is N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide is CN(CC1CCC1)C(=O)c1cnc(NN)cn1.
What is the InChIKey of N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide?
The InChIKey is LWKNIROBAIFLLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-16(7-8-3-2-4-8)11(17)9-5-14-10(15-12)6-13-9/h5-6,8H,2-4,7,12H2,1H3,(H,14,15).
What are the key properties of N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide?
N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.63, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-5-hydrazinyl-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 107378190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).