2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide

C13H22N4O2 — CID 104554464

IUPAC2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide
SMILESCCCc1cc(C(=O)N(C)C(C)CO)cc(NN)n1
InChIInChI=1S/C13H22N4O2/c1-4-5-11-6-10(7-12(15-11)16-14)13(19)17(3)9(2)8-18/h6-7,9,18H,4-5,8,14H2,1-3H3,(H,15,16)
InChIKeyIJBKQCCHUOPMPQ-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.77
Rot. Bonds6

About 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide

2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide (PubChem CID 104554464) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide
PubChem CID104554464
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide
SMILESCCCc1cc(C(=O)N(C)C(C)CO)cc(NN)n1
InChIInChI=1S/C13H22N4O2/c1-4-5-11-6-10(7-12(15-11)16-14)13(19)17(3)9(2)8-18/h6-7,9,18H,4-5,8,14H2,1-3H3,(H,15,16)
InChIKeyIJBKQCCHUOPMPQ-UHFFFAOYSA-N
XLogP0.77
TPSA91.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.77
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 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide (CID 104554464) is 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide is CCCc1cc(C(=O)N(C)C(C)CO)cc(NN)n1.
What is the InChIKey of 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide?
The InChIKey is IJBKQCCHUOPMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-4-5-11-6-10(7-12(15-11)16-14)13(19)17(3)9(2)8-18/h6-7,9,18H,4-5,8,14H2,1-3H3,(H,15,16).
What are the key properties of 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide?
2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 0.77, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(1-hydroxypropan-2-yl)-N-methyl-6-propylpyridine-4-carboxamide is sourced from PubChem (CID 104554464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).