7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide

C19H24N2O4 — CID 5262868

IUPAC7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide
SMILESCCOc1ccc2cc(C(=O)NCCN3CCCCC3)c(=O)oc2c1
InChIInChI=1S/C19H24N2O4/c1-2-24-15-7-6-14-12-16(19(23)25-17(14)13-15)18(22)20-8-11-21-9-4-3-5-10-21/h6-7,12-13H,2-5,8-11H2,1H3,(H,20,22)
InChIKeyMHMJAKKWLDXIDO-UHFFFAOYSA-N
MW344.41 g/mol
LogP2.41
Rot. Bonds6

About 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide

7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide (PubChem CID 5262868) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide.

Molecular Properties

Compound Name7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide
PubChem CID5262868
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide
SMILESCCOc1ccc2cc(C(=O)NCCN3CCCCC3)c(=O)oc2c1
InChIInChI=1S/C19H24N2O4/c1-2-24-15-7-6-14-12-16(19(23)25-17(14)13-15)18(22)20-8-11-21-9-4-3-5-10-21/h6-7,12-13H,2-5,8-11H2,1H3,(H,20,22)
InChIKeyMHMJAKKWLDXIDO-UHFFFAOYSA-N
XLogP2.41
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

7-ethoxy-2-oxo-N-prop-2-enylchromene-3-carboxamide
CID 5262767
7-ethoxy-3-(7-ethoxy-2-oxochromene-3-carbonyl)chromen-2-one
CID 139788868
4-ethoxy-N-(2-piperidin-1-ylethyl)benzamide
CID 25237098
7-ethoxy-N-(furan-2-ylmethyl)-2-oxochromene-3-carboxamide
CID 5262910
N-(2-chlorophenyl)-7-ethoxy-2-oxochromene-3-carboxamide
CID 5262992
[3-(2-methoxyethylcarbamoyl)-2-oxochromen-7-yl] 2-(4-ethoxyphenoxy)acetate
CID 19187537
7-ethoxy-N-(4-ethylphenyl)-2-oxochromene-3-carboxamide
CID 5262694
[3-(butylcarbamoyl)-2-oxochromen-7-yl] cyclohexanecarboxylate
CID 19182001
N-(2,5-dimethylphenyl)-7-ethoxy-2-oxochromene-3-carboxamide
CID 5262710
N'-(2-bromobenzoyl)-7-ethoxy-2-oxochromene-3-carbohydrazide
CID 5263152
N'-(7-ethoxy-2-oxochromene-3-carbonyl)pyridine-4-carbohydrazide
CID 5263160
methyl 2-[(7-ethoxy-2-oxochromene-3-carbonyl)amino]benzoate
CID 5262911

Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide?
The IUPAC name of 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide (CID 5262868) is 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide.
What is the SMILES notation for 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide?
The canonical SMILES for 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide is CCOc1ccc2cc(C(=O)NCCN3CCCCC3)c(=O)oc2c1.
What is the InChIKey of 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide?
The InChIKey is MHMJAKKWLDXIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-2-24-15-7-6-14-12-16(19(23)25-17(14)13-15)18(22)20-8-11-21-9-4-3-5-10-21/h6-7,12-13H,2-5,8-11H2,1H3,(H,20,22).
What are the key properties of 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide?
7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-2-oxo-N-(2-piperidin-1-ylethyl)chromene-3-carboxamide is sourced from PubChem (CID 5262868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).