7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one

C15H15NO4 — CID 122206892

IUPAC7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one
SMILESO=C(c1cc2ccc(O)cc2oc1=O)N1CCCCC1
InChIInChI=1S/C15H15NO4/c17-11-5-4-10-8-12(15(19)20-13(10)9-11)14(18)16-6-2-1-3-7-16/h4-5,8-9,17H,1-3,6-7H2
InChIKeyVPBLKXWLGFMDLO-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.12
Rot. Bonds1

About 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one

7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one (PubChem CID 122206892) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one.

Molecular Properties

Compound Name7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one
PubChem CID122206892
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one
SMILESO=C(c1cc2ccc(O)cc2oc1=O)N1CCCCC1
InChIInChI=1S/C15H15NO4/c17-11-5-4-10-8-12(15(19)20-13(10)9-11)14(18)16-6-2-1-3-7-16/h4-5,8-9,17H,1-3,6-7H2
InChIKeyVPBLKXWLGFMDLO-UHFFFAOYSA-N
XLogP2.12
TPSA70.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

Analyze 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(azepane-1-carbonyl)chromen-2-one
CID 716526
3-[4-(2-oxochromene-3-carbonyl)-1,4-diazepane-1-carbonyl]chromen-2-one
CID 1224770
3-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazine-1-carbonyl]chromen-2-one
CID 35610527
7-hydroxy-3-(2,3,4,5,6-pentafluorobenzoyl)chromen-2-one
CID 19074026
3-(2-bromoacetyl)-7-hydroxychromen-2-one
CID 6157272
7-methoxy-3-(piperazine-1-carbonyl)chromen-2-one
CID 39161891
3-[4-(cyclobutanecarbonyl)-1,4-diazepane-1-carbonyl]-7-propan-2-yloxychromen-2-one
CID 171907749
3-(4-propanoyl-1,4-diazepane-1-carbonyl)chromen-2-one
CID 110805717
7-hydroxy-N-(4-hydroxyphenyl)-2-oxochromene-3-carboxamide
CID 23730518
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-7-hydroxy-2-oxochromene-3-carboxamide
CID 135121493
7-hydroxy-3-[(E)-N-hydroxy-C-methylcarbonimidoyl]chromen-2-one
CID 135576755
3-(azocane-1-carbonyl)-8-methoxychromen-2-one
CID 6471057

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one?
The IUPAC name of 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one (CID 122206892) is 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one.
What is the SMILES notation for 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one?
The canonical SMILES for 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one is O=C(c1cc2ccc(O)cc2oc1=O)N1CCCCC1.
What is the InChIKey of 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one?
The InChIKey is VPBLKXWLGFMDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c17-11-5-4-10-8-12(15(19)20-13(10)9-11)14(18)16-6-2-1-3-7-16/h4-5,8-9,17H,1-3,6-7H2.
What are the key properties of 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one?
7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one has a molecular weight of 273.29 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-3-(piperidine-1-carbonyl)chromen-2-one is sourced from PubChem (CID 122206892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).