N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide

C13H19N5O2 — CID 81249567

IUPACN-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)NCCC(=O)NC2CC2)cn1
InChIInChI=1S/C13H19N5O2/c1-8-6-11(18-14)10(7-16-8)13(20)15-5-4-12(19)17-9-2-3-9/h6-7,9H,2-5,14H2,1H3,(H,15,20)(H,16,18)(H,17,19)
InChIKeyBJOWUYRXXXHBNX-UHFFFAOYSA-N
MW277.33 g/mol
LogP0.07
Rot. Bonds6

About N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide

N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide (PubChem CID 81249567) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
PubChem CID81249567
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC NameN-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)NCCC(=O)NC2CC2)cn1
InChIInChI=1S/C13H19N5O2/c1-8-6-11(18-14)10(7-16-8)13(20)15-5-4-12(19)17-9-2-3-9/h6-7,9H,2-5,14H2,1H3,(H,15,20)(H,16,18)(H,17,19)
InChIKeyBJOWUYRXXXHBNX-UHFFFAOYSA-N
XLogP0.07
TPSA109.14 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 50.07
H-Bond Donors ≤ 54
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-(4-amino-4-oxobutyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256346
4-hydrazinyl-6-methyl-N-pentylpyridine-3-carboxamide
CID 81255877
4-hydrazinyl-6-methyl-N-[2-(methylsulfamoyl)ethyl]pyridine-3-carboxamide
CID 106340847
4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide
CID 114098389
N-[3-(dimethylamino)propyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256000
N-[2-(ethylamino)-2-oxoethyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256875
5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-2,4-dimethylbenzamide
CID 102705738
4-hydrazinyl-6-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-3-carboxamide
CID 106025891
4-hydrazinyl-6-methyl-N-(2-thiomorpholin-4-ylethyl)pyridine-3-carboxamide
CID 106327209
4-hydrazinyl-6-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyridine-3-carboxamide
CID 81255966
4-hydrazinyl-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-methylpyridine-3-carboxamide
CID 81256702
4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide
CID 81256862

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The IUPAC name of N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide (CID 81249567) is N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide is Cc1cc(NN)c(C(=O)NCCC(=O)NC2CC2)cn1.
What is the InChIKey of N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The InChIKey is BJOWUYRXXXHBNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-8-6-11(18-14)10(7-16-8)13(20)15-5-4-12(19)17-9-2-3-9/h6-7,9H,2-5,14H2,1H3,(H,15,20)(H,16,18)(H,17,19).
What are the key properties of N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide?
N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 0.07, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81249567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).