6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide

C13H20N4O2 — CID 106909404

IUPAC6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide
SMILESNNC(=O)c1cccc(CN(CCO)C2CCC2)n1
InChIInChI=1S/C13H20N4O2/c14-16-13(19)12-6-1-3-10(15-12)9-17(7-8-18)11-4-2-5-11/h1,3,6,11,18H,2,4-5,7-9,14H2,(H,16,19)
InChIKeyUTSAFWFMFWQGAX-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.03
Rot. Bonds6

About 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide

6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide (PubChem CID 106909404) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide
PubChem CID106909404
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide
SMILESNNC(=O)c1cccc(CN(CCO)C2CCC2)n1
InChIInChI=1S/C13H20N4O2/c14-16-13(19)12-6-1-3-10(15-12)9-17(7-8-18)11-4-2-5-11/h1,3,6,11,18H,2,4-5,7-9,14H2,(H,16,19)
InChIKeyUTSAFWFMFWQGAX-UHFFFAOYSA-N
XLogP0.03
TPSA91.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909183
6-[[bis(cyclopropylmethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909293
3-[[cyclobutyl(2-hydroxyethyl)amino]methyl]benzohydrazide
CID 102873726
2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol
CID 102676529
3-[cyclobutyl-[(6-methyl-2-pyridinyl)methyl]amino]propan-1-ol
CID 102848805
6-[[butyl(methyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909022
6-[[butyl(cyclopropyl)amino]methyl]pyridine-2-carboxylic acid
CID 106904048
3-[[6-(hydrazinecarbonyl)-2-pyridinyl]methyl-methylamino]-N-methylpropanamide
CID 106918242
6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909004
6-[[2-cyanoethyl(cyclopropyl)amino]methyl]pyridine-2-carboxylic acid
CID 106904087
6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909041
6-[[bis(cyanomethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909021

Frequently Asked Questions

What is the IUPAC name of 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide (CID 106909404) is 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide is NNC(=O)c1cccc(CN(CCO)C2CCC2)n1.
What is the InChIKey of 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide?
The InChIKey is UTSAFWFMFWQGAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c14-16-13(19)12-6-1-3-10(15-12)9-17(7-8-18)11-4-2-5-11/h1,3,6,11,18H,2,4-5,7-9,14H2,(H,16,19).
What are the key properties of 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide?
6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide has a molecular weight of 264.33 g/mol, XLogP of 0.03, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 106909404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).