5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide

C12H17ClN4O — CID 63862804

IUPAC5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
SMILESCC1CC1CN(C)C(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C12H17ClN4O/c1-7-3-9(7)6-17(2)12(18)8-4-10(13)11(16-14)15-5-8/h4-5,7,9H,3,6,14H2,1-2H3,(H,15,16)
InChIKeyYZKFKVYWXMQIHM-UHFFFAOYSA-N
MW268.75 g/mol
LogP1.75
Rot. Bonds4

About 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide

5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide (PubChem CID 63862804) has the molecular formula C12H17ClN4O and a molecular weight of 268.75 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
PubChem CID63862804
Molecular FormulaC12H17ClN4O
Molecular Weight268.75 g/mol
Exact Mass268.11
IUPAC Name5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
SMILESCC1CC1CN(C)C(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C12H17ClN4O/c1-7-3-9(7)6-17(2)12(18)8-4-10(13)11(16-14)15-5-8/h4-5,7,9H,3,6,14H2,1-2H3,(H,15,16)
InChIKeyYZKFKVYWXMQIHM-UHFFFAOYSA-N
XLogP1.75
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.75
LogP ≤ 51.75
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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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide (CID 63862804) is 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide is CC1CC1CN(C)C(=O)c1cnc(NN)c(Cl)c1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide?
The InChIKey is YZKFKVYWXMQIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN4O/c1-7-3-9(7)6-17(2)12(18)8-4-10(13)11(16-14)15-5-8/h4-5,7,9H,3,6,14H2,1-2H3,(H,15,16).
What are the key properties of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide?
5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide has a molecular weight of 268.75 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 63862804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).