(3E)-3-methoxyimino-N-methylpiperidin-4-amine

C7H15N3O — CID 71567168

IUPAC(3E)-3-methoxyimino-N-methylpiperidin-4-amine
SMILESCNC1CCNC/C1=N\OC
InChIInChI=1S/C7H15N3O/c1-8-6-3-4-9-5-7(6)10-11-2/h6,8-9H,3-5H2,1-2H3/b10-7+
InChIKeyVJSAFEOQCJJKOA-JXMROGBWSA-N
MW157.22 g/mol
LogP-0.43
Rot. Bonds2

About (3E)-3-methoxyimino-N-methylpiperidin-4-amine

(3E)-3-methoxyimino-N-methylpiperidin-4-amine (PubChem CID 71567168) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is (3E)-3-methoxyimino-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name(3E)-3-methoxyimino-N-methylpiperidin-4-amine
PubChem CID71567168
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name(3E)-3-methoxyimino-N-methylpiperidin-4-amine
SMILESCNC1CCNC/C1=N\OC
InChIInChI=1S/C7H15N3O/c1-8-6-3-4-9-5-7(6)10-11-2/h6,8-9H,3-5H2,1-2H3/b10-7+
InChIKeyVJSAFEOQCJJKOA-JXMROGBWSA-N
XLogP-0.43
TPSA45.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3Z)-3-methoxyiminopiperidin-4-amine
CID 55284082
methanesulfonic acid;4-methoxyimino-N-methylpiperidin-3-amine
CID 174493599
methyl 4-piperidin-4-yl-1,2,3,6-tetrahydropyridine-5-carboxylate
CID 105482126
(2S,3R)-2-amino-3-hydroxy-N-(4-methoxyiminopiperidin-3-yl)butanamide
CID 141356278
(3E)-3-methoxyimino-4-methylpiperidin-4-amine;dihydrochloride
CID 53305610
(1S)-2-methoxyiminocyclohexan-1-amine
CID 123180049
4-(methoxymethylidene)piperidine
CID 19859122
4-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]piperidine
CID 82463437
ethane;2-methylpropanal;N-methylpyrrolidin-3-amine
CID 171505368
N-ethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-5-amine
CID 103982717
2,3-bis(methoxymethylidene)bicyclo[2.2.1]heptane
CID 71331111
N-methoxypiperidin-4-amine
CID 59857732

Frequently Asked Questions

What is the IUPAC name of (3E)-3-methoxyimino-N-methylpiperidin-4-amine?
The IUPAC name of (3E)-3-methoxyimino-N-methylpiperidin-4-amine (CID 71567168) is (3E)-3-methoxyimino-N-methylpiperidin-4-amine.
What is the SMILES notation for (3E)-3-methoxyimino-N-methylpiperidin-4-amine?
The canonical SMILES for (3E)-3-methoxyimino-N-methylpiperidin-4-amine is CNC1CCNC/C1=N\OC.
What is the InChIKey of (3E)-3-methoxyimino-N-methylpiperidin-4-amine?
The InChIKey is VJSAFEOQCJJKOA-JXMROGBWSA-N. The full InChI is InChI=1S/C7H15N3O/c1-8-6-3-4-9-5-7(6)10-11-2/h6,8-9H,3-5H2,1-2H3/b10-7+.
What are the key properties of (3E)-3-methoxyimino-N-methylpiperidin-4-amine?
(3E)-3-methoxyimino-N-methylpiperidin-4-amine has a molecular weight of 157.22 g/mol, XLogP of -0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-methoxyimino-N-methylpiperidin-4-amine is sourced from PubChem (CID 71567168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).