5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide

C12H17ClN4O — CID 62243745

IUPAC5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide
SMILESCCCN(C(=O)c1cnc(NN)c(Cl)c1)C1CC1
InChIInChI=1S/C12H17ClN4O/c1-2-5-17(9-3-4-9)12(18)8-6-10(13)11(16-14)15-7-8/h6-7,9H,2-5,14H2,1H3,(H,15,16)
InChIKeyOOOBSQDCMHYVHZ-UHFFFAOYSA-N
MW268.75 g/mol
LogP2.04
Rot. Bonds5

About 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide

5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide (PubChem CID 62243745) has the molecular formula C12H17ClN4O and a molecular weight of 268.75 g/mol. Its IUPAC name is 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide
PubChem CID62243745
Molecular FormulaC12H17ClN4O
Molecular Weight268.75 g/mol
Exact Mass268.11
IUPAC Name5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide
SMILESCCCN(C(=O)c1cnc(NN)c(Cl)c1)C1CC1
InChIInChI=1S/C12H17ClN4O/c1-2-5-17(9-3-4-9)12(18)8-6-10(13)11(16-14)15-7-8/h6-7,9H,2-5,14H2,1H3,(H,15,16)
InChIKeyOOOBSQDCMHYVHZ-UHFFFAOYSA-N
XLogP2.04
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.75
LogP ≤ 52.04
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

5-chloro-N-cyclopropyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 62238262
5-chloro-N-cyclopropyl-N-ethyl-6-(propylamino)pyridine-3-carboxamide
CID 62169292
5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide
CID 62169291
5-chloro-6-hydrazinyl-N-propan-2-yl-N-propylpyridine-3-carboxamide
CID 62242464
N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide
CID 62243561
5-chloro-N-cyclopropyl-N-(cyclopropylmethyl)-6-(ethylamino)pyridine-3-carboxamide
CID 64522048
5-chloro-N-(cyclobutylmethyl)-6-hydrazinyl-N-methylpyridine-3-carboxamide
CID 62854972
5-chloro-N-cyclopropyl-6-(methylamino)-N-(2-methylpropyl)pyridine-3-carboxamide
CID 55047231
6-amino-5-chloro-N-cyclopropyl-N-ethylpyridine-3-carboxamide
CID 62155621
5,6-dichloro-N-(1,1-dioxothiolan-3-yl)-N-propylpyridine-3-carboxamide
CID 78789197
3-chloro-N-cyclopropyl-4-hydroxy-N-propylbenzamide
CID 43270676
5-chloro-N-methyl-6-(methylamino)-N-propylpyridine-3-carboxamide
CID 62168287

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide (CID 62243745) is 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide is CCCN(C(=O)c1cnc(NN)c(Cl)c1)C1CC1.
What is the InChIKey of 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide?
The InChIKey is OOOBSQDCMHYVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN4O/c1-2-5-17(9-3-4-9)12(18)8-6-10(13)11(16-14)15-7-8/h6-7,9H,2-5,14H2,1H3,(H,15,16).
What are the key properties of 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide?
5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide has a molecular weight of 268.75 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 62243745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).