N-(4-oxochromen-8-yl)-4-propoxybenzamide

C19H17NO4 — CID 22371146

IUPACN-(4-oxochromen-8-yl)-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2cccc3c(=O)ccoc23)cc1
InChIInChI=1S/C19H17NO4/c1-2-11-23-14-8-6-13(7-9-14)19(22)20-16-5-3-4-15-17(21)10-12-24-18(15)16/h3-10,12H,2,11H2,1H3,(H,20,22)
InChIKeyIOBZODYVBYWRPS-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.83
Rot. Bonds5

About N-(4-oxochromen-8-yl)-4-propoxybenzamide

N-(4-oxochromen-8-yl)-4-propoxybenzamide (PubChem CID 22371146) has the molecular formula C19H17NO4 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(4-oxochromen-8-yl)-4-propoxybenzamide.

Molecular Properties

Compound NameN-(4-oxochromen-8-yl)-4-propoxybenzamide
PubChem CID22371146
Molecular FormulaC19H17NO4
Molecular Weight323.35 g/mol
Exact Mass323.12
IUPAC NameN-(4-oxochromen-8-yl)-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2cccc3c(=O)ccoc23)cc1
InChIInChI=1S/C19H17NO4/c1-2-11-23-14-8-6-13(7-9-14)19(22)20-16-5-3-4-15-17(21)10-12-24-18(15)16/h3-10,12H,2,11H2,1H3,(H,20,22)
InChIKeyIOBZODYVBYWRPS-UHFFFAOYSA-N
XLogP3.83
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-propoxy-N-[5-[(4-propoxybenzoyl)amino]naphthalen-1-yl]benzamide
CID 4939588
8-[(4-heptoxybenzoyl)amino]-N-hydroxy-4-oxochromene-2-carboxamide
CID 139926820
N-hydroxy-8-[(4-nonoxybenzoyl)amino]-4-oxochromene-2-carboxamide
CID 139926830
methyl 8-[(4-hexoxybenzoyl)amino]-4-oxochromene-2-carboxylate
CID 139926774
pentyl 8-[(4-octoxybenzoyl)amino]-4-oxochromene-2-carboxylate
CID 139926778
butyl 8-[(4-heptoxybenzoyl)amino]-4-oxochromene-2-carboxylate
CID 139926806
4-heptoxy-N-naphthalen-1-ylbenzamide
CID 4950571
ethyl 8-[(4-hexoxybenzoyl)amino]-4-oxochromene-2-carboxylate
CID 139926727
tert-butyl 8-[(4-heptoxybenzoyl)amino]-4-oxochromene-2-carboxylate
CID 139926792
4-butoxy-N-quinolin-5-ylbenzamide
CID 3982301
N-[2-[(4-butoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 10811951
N-(2-propan-2-ylphenyl)-4-propoxybenzamide
CID 6463952

Frequently Asked Questions

What is the IUPAC name of N-(4-oxochromen-8-yl)-4-propoxybenzamide?
The IUPAC name of N-(4-oxochromen-8-yl)-4-propoxybenzamide (CID 22371146) is N-(4-oxochromen-8-yl)-4-propoxybenzamide.
What is the SMILES notation for N-(4-oxochromen-8-yl)-4-propoxybenzamide?
The canonical SMILES for N-(4-oxochromen-8-yl)-4-propoxybenzamide is CCCOc1ccc(C(=O)Nc2cccc3c(=O)ccoc23)cc1.
What is the InChIKey of N-(4-oxochromen-8-yl)-4-propoxybenzamide?
The InChIKey is IOBZODYVBYWRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4/c1-2-11-23-14-8-6-13(7-9-14)19(22)20-16-5-3-4-15-17(21)10-12-24-18(15)16/h3-10,12H,2,11H2,1H3,(H,20,22).
What are the key properties of N-(4-oxochromen-8-yl)-4-propoxybenzamide?
N-(4-oxochromen-8-yl)-4-propoxybenzamide has a molecular weight of 323.35 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxochromen-8-yl)-4-propoxybenzamide is sourced from PubChem (CID 22371146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).