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

C27H26N4O4 — CID 141498089

IUPACN-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)Nc1ccc(Nc2nc3cc(O)ccc3cc2-c2ccc(O)cc2)cc1
InChIInChI=1S/C27H26N4O4/c32-22-8-1-18(2-9-22)24-15-19-3-10-23(33)16-25(19)30-27(24)29-21-6-4-20(5-7-21)28-26(34)17-31-11-13-35-14-12-31/h1-10,15-16,32-33H,11-14,17H2,(H,28,34)(H,29,30)
InChIKeyZXIGHWRKZNMJSZ-UHFFFAOYSA-N
MW470.53 g/mol
LogP4.33
Rot. Bonds6

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

N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide (PubChem CID 141498089) has the molecular formula C27H26N4O4 and a molecular weight of 470.53 g/mol. Its IUPAC name is N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide
PubChem CID141498089
Molecular FormulaC27H26N4O4
Molecular Weight470.53 g/mol
Exact Mass470.20
IUPAC NameN-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)Nc1ccc(Nc2nc3cc(O)ccc3cc2-c2ccc(O)cc2)cc1
InChIInChI=1S/C27H26N4O4/c32-22-8-1-18(2-9-22)24-15-19-3-10-23(33)16-25(19)30-27(24)29-21-6-4-20(5-7-21)28-26(34)17-31-11-13-35-14-12-31/h1-10,15-16,32-33H,11-14,17H2,(H,28,34)(H,29,30)
InChIKeyZXIGHWRKZNMJSZ-UHFFFAOYSA-N
XLogP4.33
TPSA106.95 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.53
LogP ≤ 54.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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Related Compounds

2-morpholin-4-yl-N-[6-[(2-morpholin-4-ylacetyl)amino]acridin-3-yl]acetamide;dihydrate;trihydrochloride
CID 21438204
N-(4-iodophenyl)-2-morpholin-4-ylacetamide
CID 677187
ethane;N-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 142923820
N-[4-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide
CID 16612015
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CID 649229
N-(4-ethynylphenyl)-2-morpholin-4-ylacetamide
CID 46844280
3-amino-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide;dihydrochloride
CID 119840811
N-(4-methoxyphenyl)-2-morpholin-4-ylacetamide;oxalic acid
CID 11948773
2-morpholin-4-yl-N-(2-naphthalen-2-yl-1,3-benzoxazol-5-yl)acetamide
CID 25211123
N-(4-hydroxyphenyl)-2-piperazin-1-ylacetamide
CID 60850914
N-(3,4-dichlorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
CID 78835221
N-[4-(4-methylphenoxy)phenyl]-2-morpholin-4-ylacetamide
CID 8903812

Frequently Asked Questions

What is the IUPAC name of N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide (CID 141498089) is N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide is O=C(CN1CCOCC1)Nc1ccc(Nc2nc3cc(O)ccc3cc2-c2ccc(O)cc2)cc1.
What is the InChIKey of N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is ZXIGHWRKZNMJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N4O4/c32-22-8-1-18(2-9-22)24-15-19-3-10-23(33)16-25(19)30-27(24)29-21-6-4-20(5-7-21)28-26(34)17-31-11-13-35-14-12-31/h1-10,15-16,32-33H,11-14,17H2,(H,28,34)(H,29,30).
What are the key properties of N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide?
N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 470.53 g/mol, XLogP of 4.33, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[7-hydroxy-3-(4-hydroxyphenyl)quinolin-2-yl]amino]phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 141498089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).