5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide

C13H23N5O — CID 106025870

IUPAC5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
SMILESCCCCC(CCC)NC(=O)c1cnc(NN)cn1
InChIInChI=1S/C13H23N5O/c1-3-5-7-10(6-4-2)17-13(19)11-8-16-12(18-14)9-15-11/h8-10H,3-7,14H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyITLPGDNSQUILNN-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.85
Rot. Bonds8

About 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide

5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide (PubChem CID 106025870) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
PubChem CID106025870
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
SMILESCCCCC(CCC)NC(=O)c1cnc(NN)cn1
InChIInChI=1S/C13H23N5O/c1-3-5-7-10(6-4-2)17-13(19)11-8-16-12(18-14)9-15-11/h8-10H,3-7,14H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyITLPGDNSQUILNN-UHFFFAOYSA-N
XLogP1.85
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.85
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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Related Compounds

5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide
CID 107377682
5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide
CID 107377765
5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
CID 106027811
5-hydrazinyl-N-(4-methoxybutan-2-yl)pyrazine-2-carboxamide
CID 107378401
5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide
CID 107375376
5-chloro-N-(1-hydroxyhexan-2-yl)pyrazine-2-carboxamide
CID 122604026
5-hydrazinyl-N-methyl-N-pentan-2-ylpyrazine-2-carboxamide
CID 107377494
4-hydrazinyl-N-octan-4-ylpyridine-3-carboxamide
CID 114138357
5-(ethylamino)-N-pentan-2-ylpyrazine-2-carboxamide
CID 107373939
6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide
CID 106027867
N-octan-4-yl-6-(propylamino)pyridazine-3-carboxamide
CID 106027845
4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
CID 106027853

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide (CID 106025870) is 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide is CCCCC(CCC)NC(=O)c1cnc(NN)cn1.
What is the InChIKey of 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide?
The InChIKey is ITLPGDNSQUILNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-5-7-10(6-4-2)17-13(19)11-8-16-12(18-14)9-15-11/h8-10H,3-7,14H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide?
5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.85, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide is sourced from PubChem (CID 106025870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).