N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide

C13H20N4O — CID 105071708

IUPACN-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide
SMILESCCCCN(C(=O)c1ccncc1NN)C1CC1
InChIInChI=1S/C13H20N4O/c1-2-3-8-17(10-4-5-10)13(18)11-6-7-15-9-12(11)16-14/h6-7,9-10,16H,2-5,8,14H2,1H3
InChIKeySEBGVFDLKUUNEV-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.77
Rot. Bonds6

About N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide

N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide (PubChem CID 105071708) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide
PubChem CID105071708
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC NameN-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide
SMILESCCCCN(C(=O)c1ccncc1NN)C1CC1
InChIInChI=1S/C13H20N4O/c1-2-3-8-17(10-4-5-10)13(18)11-6-7-15-9-12(11)16-14/h6-7,9-10,16H,2-5,8,14H2,1H3
InChIKeySEBGVFDLKUUNEV-UHFFFAOYSA-N
XLogP1.77
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-cyclopropyl-3-(methylamino)-N-propylpyridine-4-carboxamide
CID 105068558
N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide
CID 81242322
N-ethyl-3-hydrazinyl-N-propylpyridine-4-carboxamide
CID 105072006
N-cyclobutyl-3-hydrazinyl-N-methylpyridine-4-carboxamide
CID 105072506
N-(2-cyanoethyl)-N-cyclopropyl-3-(propylamino)pyridine-4-carboxamide
CID 105069192
N-cyclopentyl-N-ethyl-4-hydrazinylpyridine-3-carboxamide
CID 81256694
N-(cyclobutylmethyl)-N-ethyl-3-hydrazinylpyridine-4-carboxamide
CID 107401447
N-butyl-N-cyclopropyl-2-(propylamino)benzamide
CID 62179116
3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide
CID 105071832
N-butyl-3-chloro-N-(1,1-dioxothiolan-3-yl)pyridine-4-carboxamide
CID 66481975
N-butyl-N-cyclopropyl-6-hydrazinylpyridine-2-carboxamide
CID 62237201
N-butyl-3-chloro-N-cyclopropyl-6-hydrazinylpyridine-2-carboxamide
CID 62237031

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide (CID 105071708) is N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide is CCCCN(C(=O)c1ccncc1NN)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is SEBGVFDLKUUNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-3-8-17(10-4-5-10)13(18)11-6-7-15-9-12(11)16-14/h6-7,9-10,16H,2-5,8,14H2,1H3.
What are the key properties of N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide?
N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 105071708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).