O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine

C7H14N2O — CID 117206000

IUPACO-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine
SMILESCN1CCC=C(CON)C1
InChIInChI=1S/C7H14N2O/c1-9-4-2-3-7(5-9)6-10-8/h3H,2,4-6,8H2,1H3
InChIKeyXQMFDRZEROWKDL-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.14
Rot. Bonds2

About O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine

O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine (PubChem CID 117206000) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine
PubChem CID117206000
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameO-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine
SMILESCN1CCC=C(CON)C1
InChIInChI=1S/C7H14N2O/c1-9-4-2-3-7(5-9)6-10-8/h3H,2,4-6,8H2,1H3
InChIKeyXQMFDRZEROWKDL-UHFFFAOYSA-N
XLogP0.14
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-5-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methoxymethyl]-3,6-dihydro-2H-pyridine
CID 23500777
5-(fluoromethyl)-1-methyl-3,6-dihydro-2H-pyridine
CID 117205570
1-methyl-5-(prop-2-ynoxymethyl)-3,6-dihydro-2H-pyridine;hydrochloride
CID 117069152
5-(chloromethyl)-1-methyl-3,6-dihydro-2H-pyridine;hydrochloride
CID 14615850
N,N-dimethyl-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanamine
CID 117205559
N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanamine
CID 139581381
1-methyl-5-(2,2,2-trifluoroethyl)-3,6-dihydro-2H-pyridine
CID 117205566
1-methyl-5-(nitrosomethyl)-3,6-dihydro-2H-pyridine
CID 57152000
[2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)ethylideneamino] acetate
CID 54494276
5-[(4-fluoro-2-propylphenoxy)methyl]-1-methyl-3,6-dihydro-2H-pyridine
CID 139679463
methoxy-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanamine
CID 153439808
5-(cyclohexa-1,3-dien-1-ylmethyl)-1-methyl-3,6-dihydro-2H-pyridine
CID 168995095

Frequently Asked Questions

What is the IUPAC name of O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine?
The IUPAC name of O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine (CID 117206000) is O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine.
What is the SMILES notation for O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine?
The canonical SMILES for O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine is CN1CCC=C(CON)C1.
What is the InChIKey of O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine?
The InChIKey is XQMFDRZEROWKDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-9-4-2-3-7(5-9)6-10-8/h3H,2,4-6,8H2,1H3.
What are the key properties of O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine?
O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine has a molecular weight of 142.20 g/mol, XLogP of 0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]hydroxylamine is sourced from PubChem (CID 117206000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).