N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane

C10H20N2O2 — CID 142314358

IUPACN-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane
SMILESCC.CC1=CC(N(O)C=O)CN(C)C1
InChIInChI=1S/C8H14N2O2.C2H6/c1-7-3-8(10(12)6-11)5-9(2)4-7;1-2/h3,6,8,12H,4-5H2,1-2H3;1-2H3
InChIKeyHZUOWYDLFQSOGI-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.12
Rot. Bonds2

About N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane

N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane (PubChem CID 142314358) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane.

Molecular Properties

Compound NameN-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane
PubChem CID142314358
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane
SMILESCC.CC1=CC(N(O)C=O)CN(C)C1
InChIInChI=1S/C8H14N2O2.C2H6/c1-7-3-8(10(12)6-11)5-9(2)4-7;1-2/h3,6,8,12H,4-5H2,1-2H3;1-2H3
InChIKeyHZUOWYDLFQSOGI-UHFFFAOYSA-N
XLogP1.12
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.12
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-(2-methylpropoxy)formamide
CID 134398301
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-prop-2-enoxyformamide;ethane
CID 142314294
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-propoxyformamide;ethane
CID 142314306
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-propoxyformamide;ethane;methanethiol
CID 142314321
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-propoxyformamide;ethane
CID 142314322
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-prop-2-enoxyformamide;ethane
CID 142314323
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-prop-2-enoxyformamide;ethane;methane
CID 142314328
N-hydroxy-N-[(3R)-1-methyl-3,6-dihydro-2H-pyridin-3-yl]formamide
CID 142314349
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-methylformamide;ethane
CID 142314392
N-[(3R)-1,4-dimethyl-3,6-dihydro-2H-pyridin-3-yl]-N-prop-2-enoxyformamide;ethane;formaldehyde;methanamine
CID 145162115
N-[(3R)-1,4-dimethyl-3,6-dihydro-2H-pyridin-3-yl]-N-prop-2-enoxyformamide;ethane;methanol
CID 145162116
N-(1-methyl-5-trimethylstannyl-3,6-dihydro-2H-pyridin-3-yl)-N-propoxyformamide
CID 145183032

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane?
The IUPAC name of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane (CID 142314358) is N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane.
What is the SMILES notation for N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane?
The canonical SMILES for N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane is CC.CC1=CC(N(O)C=O)CN(C)C1.
What is the InChIKey of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane?
The InChIKey is HZUOWYDLFQSOGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2.C2H6/c1-7-3-8(10(12)6-11)5-9(2)4-7;1-2/h3,6,8,12H,4-5H2,1-2H3;1-2H3.
What are the key properties of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane?
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane has a molecular weight of 200.28 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-3-yl)-N-hydroxyformamide;ethane is sourced from PubChem (CID 142314358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).