N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide

C29H33N3O6 — CID 51003497

IUPACN-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)Nc1ccc(-c2cccc3c(=O)cc(N4CCOCC4)oc23)cc1OCC1CC1
InChIInChI=1S/C29H33N3O6/c33-25-17-28(32-10-14-36-15-11-32)38-29-22(2-1-3-23(25)29)21-6-7-24(26(16-21)37-19-20-4-5-20)30-27(34)18-31-8-12-35-13-9-31/h1-3,6-7,16-17,20H,4-5,8-15,18-19H2,(H,30,34)
InChIKeyYUZWKYFHKYQPMO-UHFFFAOYSA-N
MW519.60 g/mol
LogP3.36
Rot. Bonds8

About N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide

N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide (PubChem CID 51003497) has the molecular formula C29H33N3O6 and a molecular weight of 519.60 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide
PubChem CID51003497
Molecular FormulaC29H33N3O6
Molecular Weight519.60 g/mol
Exact Mass519.24
IUPAC NameN-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)Nc1ccc(-c2cccc3c(=O)cc(N4CCOCC4)oc23)cc1OCC1CC1
InChIInChI=1S/C29H33N3O6/c33-25-17-28(32-10-14-36-15-11-32)38-29-22(2-1-3-23(25)29)21-6-7-24(26(16-21)37-19-20-4-5-20)30-27(34)18-31-8-12-35-13-9-31/h1-3,6-7,16-17,20H,4-5,8-15,18-19H2,(H,30,34)
InChIKeyYUZWKYFHKYQPMO-UHFFFAOYSA-N
XLogP3.36
TPSA93.48 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500519.60
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide 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

Upidosin
CID 148842
AZ-10419369 C-11
CID 42608431
[N-methyl-3H(3)]AZ-10419369
CID 25067576
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3-methyl-4-oxo-2-phenylchromene-8-carboxamide
CID 19972519
7-fluoro-4-oxo-N-(1-((3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin-7-yl)methyl)piperidin-4-yl)-4H-chromene-2-carboxamide
CID 44417937
N-(2-isopropoxy-4-(2-morpholino-4-oxo-4H-chromen-8-yl)phenyl)-2-morpholinoacetamide
CID 53316474
2-morpholino-N-(5-(2-morpholino-4-oxo-4H-chromen-8-yl)biphenyl-2-yl)acetamide
CID 53317813
N-(2-isobutoxy-4-(2-morpholino-4-oxo-4H-chromen-8-yl)phenyl)-2-morpholinoacetamide
CID 53319118
N-(2-(2-hydroxyethoxy)-4-(2-morpholino-4-oxo-4H-chromen-8-yl)phenyl)-2-morpholinoacetamide
CID 53320358
N-(2-hydroxy-4-(2-morpholino-4-oxo-4H-chromen-8-yl)phenyl)-2-morpholinoacetamide
CID 53320444
N-(2-(allyloxy)-4-(2-morpholino-4-oxo-4H-chromen-8-yl)phenyl)-2-morpholinoacetamide
CID 53323075
N-(2-(cyclobutylmethoxy)-4-(2-morpholino-4-oxo-4H-chromen-8-yl)phenyl)-2-morpholinoacetamide
CID 53323077

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide (CID 51003497) is N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide is O=C(CN1CCOCC1)Nc1ccc(-c2cccc3c(=O)cc(N4CCOCC4)oc23)cc1OCC1CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is YUZWKYFHKYQPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33N3O6/c33-25-17-28(32-10-14-36-15-11-32)38-29-22(2-1-3-23(25)29)21-6-7-24(26(16-21)37-19-20-4-5-20)30-27(34)18-31-8-12-35-13-9-31/h1-3,6-7,16-17,20H,4-5,8-15,18-19H2,(H,30,34).
What are the key properties of N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide?
N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 519.60 g/mol, XLogP of 3.36, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)-4-(2-morpholin-4-yl-4-oxochromen-8-yl)phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 51003497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).