N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide

C29H30N4O4 — CID 141498092

IUPACN-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide
SMILESCOc1ccc(-c2cc3ccc(OC)cc3nc2Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1
InChIInChI=1S/C29H30N4O4/c1-35-24-10-3-20(4-11-24)26-17-21-5-12-25(36-2)18-27(21)32-29(26)31-23-8-6-22(7-9-23)30-28(34)19-33-13-15-37-16-14-33/h3-12,17-18H,13-16,19H2,1-2H3,(H,30,34)(H,31,32)
InChIKeyIOLYSDLOSXJBJI-UHFFFAOYSA-N
MW498.58 g/mol
LogP4.93
Rot. Bonds8

About N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide

N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide (PubChem CID 141498092) has the molecular formula C29H30N4O4 and a molecular weight of 498.58 g/mol. Its IUPAC name is N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide
PubChem CID141498092
Molecular FormulaC29H30N4O4
Molecular Weight498.58 g/mol
Exact Mass498.23
IUPAC NameN-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide
SMILESCOc1ccc(-c2cc3ccc(OC)cc3nc2Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1
InChIInChI=1S/C29H30N4O4/c1-35-24-10-3-20(4-11-24)26-17-21-5-12-25(36-2)18-27(21)32-29(26)31-23-8-6-22(7-9-23)30-28(34)19-33-13-15-37-16-14-33/h3-12,17-18H,13-16,19H2,1-2H3,(H,30,34)(H,31,32)
InChIKeyIOLYSDLOSXJBJI-UHFFFAOYSA-N
XLogP4.93
TPSA84.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.58
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide with MolForge

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Related Compounds

2-(dimethylamino)-N-[3-[[1-[2-(2-methylquinolin-5-yl)oxyethyl]piperidin-4-yl]methyl]phenyl]acetamide
CID 10127673
N-(3-{4-[2-(2-Methylquinolin-5-yloxy)ethyl]piperazin-1-ylmethyl}phenyl)-acetamide
CID 10237964
[4-(4-Amino-6,7-dimethoxyquinolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone
CID 14069005
4-(4-amino-6,7-dimethoxyquinolin-2-yl)-N-phenylpiperazine-1-carboxamide
CID 14069011
N-(4-methyl-2-(2-(piperidin-1-yl)ethylamino)quinolin-6-yl)-2-(4-(trifluoromethoxy)phenoxy)acetamide
CID 44407944
4-(2-Methylquinazoline-4-yl)-7-methoxy-3,4-dihydroquinoxaline-2(1H)-one
CID 71543088
4-(2-chloroquinazolin-4-yl)-7-methoxy-3,4-dihydroquinoxalin-2(1H)-one
CID 137645573
4-[2-(Ethylamino)quinazolin-4-yl]-7-methoxy-1,3-dihydroquinoxalin-2-one
CID 137653815
7-Methoxy-2-morpholin-4-ylquinoline-3-carbonitrile
CID 855274
1-(2-Ethoxyphenyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]urea
CID 16023475
(2E)-N-[2-(4-Ethylpiperazin-1-YL)-4-methylquinolin-6-YL]-3-(4-methoxyphenyl)prop-2-enamide
CID 44403742
N-(4-Methyl-2-piperidin-1-yl-quinolin-6-yl)-2-(4-trifluoromethoxy-phenoxy)-acetamide
CID 11705240

Frequently Asked Questions

What is the IUPAC name of N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide (CID 141498092) is N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide is COc1ccc(-c2cc3ccc(OC)cc3nc2Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1.
What is the InChIKey of N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is IOLYSDLOSXJBJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30N4O4/c1-35-24-10-3-20(4-11-24)26-17-21-5-12-25(36-2)18-27(21)32-29(26)31-23-8-6-22(7-9-23)30-28(34)19-33-13-15-37-16-14-33/h3-12,17-18H,13-16,19H2,1-2H3,(H,30,34)(H,31,32).
What are the key properties of N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 498.58 g/mol, XLogP of 4.93, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[7-methoxy-3-(4-methoxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 141498092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).