N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide

C22H23N3O5 — CID 155546029

IUPACN-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide
SMILESCOc1ccc2c(Nc3ccc(NC(=O)CN4CCOCC4)cc3)cc(=O)oc2c1
InChIInChI=1S/C22H23N3O5/c1-28-17-6-7-18-19(13-22(27)30-20(18)12-17)23-15-2-4-16(5-3-15)24-21(26)14-25-8-10-29-11-9-25/h2-7,12-13,23H,8-11,14H2,1H3,(H,24,26)
InChIKeyLRXJPYAJXDGMTL-UHFFFAOYSA-N
MW409.44 g/mol
LogP2.82
Rot. Bonds6

About N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide

N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide (PubChem CID 155546029) has the molecular formula C22H23N3O5 and a molecular weight of 409.44 g/mol. Its IUPAC name is N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide
PubChem CID155546029
Molecular FormulaC22H23N3O5
Molecular Weight409.44 g/mol
Exact Mass409.16
IUPAC NameN-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide
SMILESCOc1ccc2c(Nc3ccc(NC(=O)CN4CCOCC4)cc3)cc(=O)oc2c1
InChIInChI=1S/C22H23N3O5/c1-28-17-6-7-18-19(13-22(27)30-20(18)12-17)23-15-2-4-16(5-3-15)24-21(26)14-25-8-10-29-11-9-25/h2-7,12-13,23H,8-11,14H2,1H3,(H,24,26)
InChIKeyLRXJPYAJXDGMTL-UHFFFAOYSA-N
XLogP2.82
TPSA93.04 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.44
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]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

N-(4-methoxyphenyl)-2-morpholin-4-ylacetamide;oxalic acid
CID 11948773
N-[4-(4-methylphenoxy)phenyl]-2-morpholin-4-ylacetamide
CID 8903812
(2S)-2-(6-methoxynaphthalen-2-yl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide
CID 55941741
ethane;N-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 142923820
(2S)-3-hydroxy-2-[[2-(7-methoxy-2-oxochromen-4-yl)acetyl]amino]-N-(2-morpholin-4-ylethyl)propanamide
CID 6723132
7-methoxy-N-(4-morpholin-4-ylphenyl)-4-oxochromene-2-carboxamide
CID 51998270
N-(4-methoxyphenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]acetamide
CID 9129962
N-(4-iodophenyl)-2-morpholin-4-ylacetamide
CID 677187
N-(7-amino-9-oxoxanthen-3-yl)-2-morpholin-4-ylacetamide
CID 162787858
2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]-N-(3-methoxyphenyl)acetamide
CID 27444932
4-(4-tert-butylphenoxy)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]butanamide
CID 16612050
N-[4-(2-oxochromen-4-yl)oxyphenyl]-2-piperidin-1-ylacetamide
CID 155550891

Frequently Asked Questions

What is the IUPAC name of N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide (CID 155546029) is N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide is COc1ccc2c(Nc3ccc(NC(=O)CN4CCOCC4)cc3)cc(=O)oc2c1.
What is the InChIKey of N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is LRXJPYAJXDGMTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O5/c1-28-17-6-7-18-19(13-22(27)30-20(18)12-17)23-15-2-4-16(5-3-15)24-21(26)14-25-8-10-29-11-9-25/h2-7,12-13,23H,8-11,14H2,1H3,(H,24,26).
What are the key properties of N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide?
N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 409.44 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(7-methoxy-2-oxochromen-4-yl)amino]phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 155546029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).