(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine

C15H15N3O — CID 124502165

IUPAC(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine
SMILESCc1cc(N2CCc3ccccc32)ncc1/C=N\O
InChIInChI=1S/C15H15N3O/c1-11-8-15(16-9-13(11)10-17-19)18-7-6-12-4-2-3-5-14(12)18/h2-5,8-10,19H,6-7H2,1H3/b17-10-
InChIKeyRSEBMNWMABBZBO-YVLHZVERSA-N
MW253.31 g/mol
LogP2.89
Rot. Bonds2

About (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine

(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine (PubChem CID 124502165) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine
PubChem CID124502165
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine
SMILESCc1cc(N2CCc3ccccc32)ncc1/C=N\O
InChIInChI=1S/C15H15N3O/c1-11-8-15(16-9-13(11)10-17-19)18-7-6-12-4-2-3-5-14(12)18/h2-5,8-10,19H,6-7H2,1H3/b17-10-
InChIKeyRSEBMNWMABBZBO-YVLHZVERSA-N
XLogP2.89
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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 (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine (CID 124502165) is (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine is Cc1cc(N2CCc3ccccc32)ncc1/C=N\O.
What is the InChIKey of (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine?
The InChIKey is RSEBMNWMABBZBO-YVLHZVERSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11-8-15(16-9-13(11)10-17-19)18-7-6-12-4-2-3-5-14(12)18/h2-5,8-10,19H,6-7H2,1H3/b17-10-.
What are the key properties of (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine?
(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine has a molecular weight of 253.31 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine is sourced from PubChem (CID 124502165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).