N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide

C10H14N2O2 — CID 5289331

IUPACN-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide
SMILESCc1cccc(CCCN(O)C=O)n1
InChIInChI=1S/C10H14N2O2/c1-9-4-2-5-10(11-9)6-3-7-12(14)8-13/h2,4-5,8,14H,3,6-7H2,1H3
InChIKeyFJYUGRZKJXCRFF-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.17
Rot. Bonds5

About N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide

N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide (PubChem CID 5289331) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide.

Molecular Properties

Compound NameN-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide
PubChem CID5289331
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide
SMILESCc1cccc(CCCN(O)C=O)n1
InChIInChI=1S/C10H14N2O2/c1-9-4-2-5-10(11-9)6-3-7-12(14)8-13/h2,4-5,8,14H,3,6-7H2,1H3
InChIKeyFJYUGRZKJXCRFF-UHFFFAOYSA-N
XLogP1.17
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', '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 N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide?
The IUPAC name of N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide (CID 5289331) is N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide.
What is the SMILES notation for N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide?
The canonical SMILES for N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide is Cc1cccc(CCCN(O)C=O)n1.
What is the InChIKey of N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide?
The InChIKey is FJYUGRZKJXCRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-9-4-2-5-10(11-9)6-3-7-12(14)8-13/h2,4-5,8,14H,3,6-7H2,1H3.
What are the key properties of N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide?
N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide has a molecular weight of 194.23 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-[3-(6-methyl-2-pyridinyl)propyl]formamide is sourced from PubChem (CID 5289331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).