4-[(methoxyamino)methyl]pyridin-2-amine

C7H11N3O — CID 131155794

IUPAC4-[(methoxyamino)methyl]pyridin-2-amine
SMILESCONCc1ccnc(N)c1
InChIInChI=1S/C7H11N3O/c1-11-10-5-6-2-3-9-7(8)4-6/h2-4,10H,5H2,1H3,(H2,8,9)
InChIKeyRSVVNXMMWZILQW-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.31
Rot. Bonds3

About 4-[(methoxyamino)methyl]pyridin-2-amine

4-[(methoxyamino)methyl]pyridin-2-amine (PubChem CID 131155794) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 4-[(methoxyamino)methyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[(methoxyamino)methyl]pyridin-2-amine
PubChem CID131155794
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name4-[(methoxyamino)methyl]pyridin-2-amine
SMILESCONCc1ccnc(N)c1
InChIInChI=1S/C7H11N3O/c1-11-10-5-6-2-3-9-7(8)4-6/h2-4,10H,5H2,1H3,(H2,8,9)
InChIKeyRSVVNXMMWZILQW-UHFFFAOYSA-N
XLogP0.31
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(methoxyamino)methyl]pyridin-2-amine?
The IUPAC name of 4-[(methoxyamino)methyl]pyridin-2-amine (CID 131155794) is 4-[(methoxyamino)methyl]pyridin-2-amine.
What is the SMILES notation for 4-[(methoxyamino)methyl]pyridin-2-amine?
The canonical SMILES for 4-[(methoxyamino)methyl]pyridin-2-amine is CONCc1ccnc(N)c1.
What is the InChIKey of 4-[(methoxyamino)methyl]pyridin-2-amine?
The InChIKey is RSVVNXMMWZILQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-11-10-5-6-2-3-9-7(8)4-6/h2-4,10H,5H2,1H3,(H2,8,9).
What are the key properties of 4-[(methoxyamino)methyl]pyridin-2-amine?
4-[(methoxyamino)methyl]pyridin-2-amine has a molecular weight of 153.18 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(methoxyamino)methyl]pyridin-2-amine is sourced from PubChem (CID 131155794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).