6-(aminomethoxy)-2-phenylchromen-4-one

C16H13NO3 — CID 174632980

IUPAC6-(aminomethoxy)-2-phenylchromen-4-one
SMILESNCOc1ccc2oc(-c3ccccc3)cc(=O)c2c1
InChIInChI=1S/C16H13NO3/c17-10-19-12-6-7-15-13(8-12)14(18)9-16(20-15)11-4-2-1-3-5-11/h1-9H,10,17H2
InChIKeyRRLWDEMAWNJVKX-UHFFFAOYSA-N
MW267.28 g/mol
LogP2.76
Rot. Bonds3

About 6-(aminomethoxy)-2-phenylchromen-4-one

6-(aminomethoxy)-2-phenylchromen-4-one (PubChem CID 174632980) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is 6-(aminomethoxy)-2-phenylchromen-4-one.

Molecular Properties

Compound Name6-(aminomethoxy)-2-phenylchromen-4-one
PubChem CID174632980
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name6-(aminomethoxy)-2-phenylchromen-4-one
SMILESNCOc1ccc2oc(-c3ccccc3)cc(=O)c2c1
InChIInChI=1S/C16H13NO3/c17-10-19-12-6-7-15-13(8-12)14(18)9-16(20-15)11-4-2-1-3-5-11/h1-9H,10,17H2
InChIKeyRRLWDEMAWNJVKX-UHFFFAOYSA-N
XLogP2.76
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

7-(aminomethoxy)-2-phenylchromen-4-one
CID 88981514
6-(chloromethoxy)-2-phenylchromen-4-one
CID 174619447
6-(3-bromopropoxy)-2-phenylchromen-4-one
CID 139992556
6-[2-(dimethylamino)ethoxy]-2-phenylchromen-4-one
CID 14982949
6-methoxy-2-phenylchromen-4-one;hydrate
CID 174958280
5-hydroxy-1-methyl-2-[(4-oxo-2-phenylchromen-6-yl)oxymethyl]pyridin-4-one
CID 11014249
2-(4-aminophenyl)-6-propoxychromen-4-one
CID 82046490
6-[6-[2-hydroxyethyl(methyl)amino]hexoxy]-2-phenylchromen-4-one
CID 14982977
N-(4-fluorophenyl)-2-(4-oxo-2-phenylchromen-6-yl)oxyacetamide
CID 44587554
2-phenylchromen-4-one
CID 90124083
6-benzyl-2-phenylchromen-4-one
CID 90747479
6-ethyl-2-phenylchromen-4-one
CID 10999458

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethoxy)-2-phenylchromen-4-one?
The IUPAC name of 6-(aminomethoxy)-2-phenylchromen-4-one (CID 174632980) is 6-(aminomethoxy)-2-phenylchromen-4-one.
What is the SMILES notation for 6-(aminomethoxy)-2-phenylchromen-4-one?
The canonical SMILES for 6-(aminomethoxy)-2-phenylchromen-4-one is NCOc1ccc2oc(-c3ccccc3)cc(=O)c2c1.
What is the InChIKey of 6-(aminomethoxy)-2-phenylchromen-4-one?
The InChIKey is RRLWDEMAWNJVKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c17-10-19-12-6-7-15-13(8-12)14(18)9-16(20-15)11-4-2-1-3-5-11/h1-9H,10,17H2.
What are the key properties of 6-(aminomethoxy)-2-phenylchromen-4-one?
6-(aminomethoxy)-2-phenylchromen-4-one has a molecular weight of 267.28 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethoxy)-2-phenylchromen-4-one is sourced from PubChem (CID 174632980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).