N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide

C13H23N5O — CID 114133340

IUPACN-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide
SMILESCCC(C)N(C)CCNC(=O)c1ccnc(NN)c1
InChIInChI=1S/C13H23N5O/c1-4-10(2)18(3)8-7-16-13(19)11-5-6-15-12(9-11)17-14/h5-6,9-10H,4,7-8,14H2,1-3H3,(H,15,17)(H,16,19)
InChIKeyLQTOIYWQPAYUGV-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.83
Rot. Bonds7

About N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide

N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide (PubChem CID 114133340) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide
PubChem CID114133340
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC NameN-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide
SMILESCCC(C)N(C)CCNC(=O)c1ccnc(NN)c1
InChIInChI=1S/C13H23N5O/c1-4-10(2)18(3)8-7-16-13(19)11-5-6-15-12(9-11)17-14/h5-6,9-10H,4,7-8,14H2,1-3H3,(H,15,17)(H,16,19)
InChIKeyLQTOIYWQPAYUGV-UHFFFAOYSA-N
XLogP0.83
TPSA83.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.83
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

N-[2-[methyl(propan-2-yl)amino]ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62640587
2-hydrazinyl-N-(5-methylhexyl)pyridine-4-carboxamide
CID 115327351
2-hydrazinyl-N-(7-methyloctyl)pyridine-4-carboxamide
CID 107818117
3-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]benzamide
CID 103814251
2-hydrazinyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-4-carboxamide
CID 62243779
6-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]pyridine-3-carboxamide
CID 114134948
N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
CID 79470982
N-[2-[[(2R)-butan-2-yl]-methylamino]ethyl]-3-fluorobenzamide
CID 95167816
2-fluoro-N-[2-[methyl(propan-2-yl)amino]ethyl]pyridine-4-carboxamide
CID 62641304
2-(methylamino)-N-(2-methylbutyl)pyridine-4-carboxamide
CID 62694012
2-hydrazinyl-N,N-dimethylpyridine-4-carboxamide
CID 62236400
N-[2-(carbamoylamino)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 83115078

Frequently Asked Questions

What is the IUPAC name of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide (CID 114133340) is N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide is CCC(C)N(C)CCNC(=O)c1ccnc(NN)c1.
What is the InChIKey of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide?
The InChIKey is LQTOIYWQPAYUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-4-10(2)18(3)8-7-16-13(19)11-5-6-15-12(9-11)17-14/h5-6,9-10H,4,7-8,14H2,1-3H3,(H,15,17)(H,16,19).
What are the key properties of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide?
N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.83, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 114133340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).