N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide

C20H19ClN2O3 — CID 68762927

IUPACN-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide
SMILESCOc1ccc(Oc2ccc3nc(CCNC(C)=O)ccc3c2)c(Cl)c1
InChIInChI=1S/C20H19ClN2O3/c1-13(24)22-10-9-15-4-3-14-11-17(5-7-19(14)23-15)26-20-8-6-16(25-2)12-18(20)21/h3-8,11-12H,9-10H2,1-2H3,(H,22,24)
InChIKeyPNUKOKDUVRZRAF-UHFFFAOYSA-N
MW370.84 g/mol
LogP4.37
Rot. Bonds6

About N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide

N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide (PubChem CID 68762927) has the molecular formula C20H19ClN2O3 and a molecular weight of 370.84 g/mol. Its IUPAC name is N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide
PubChem CID68762927
Molecular FormulaC20H19ClN2O3
Molecular Weight370.84 g/mol
Exact Mass370.11
IUPAC NameN-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide
SMILESCOc1ccc(Oc2ccc3nc(CCNC(C)=O)ccc3c2)c(Cl)c1
InChIInChI=1S/C20H19ClN2O3/c1-13(24)22-10-9-15-4-3-14-11-17(5-7-19(14)23-15)26-20-8-6-16(25-2)12-18(20)21/h3-8,11-12H,9-10H2,1-2H3,(H,22,24)
InChIKeyPNUKOKDUVRZRAF-UHFFFAOYSA-N
XLogP4.37
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[6-[2-chloro-4-[3-(dimethylamino)propoxy]phenoxy]naphthalen-2-yl]ethyl]acetamide
CID 68763289
3-(6-methoxyquinolin-2-yl)-N,N-dimethylpropan-1-amine
CID 23204412
(6-methoxyquinolin-2-yl)methylphosphonic acid
CID 67774367
2-(2-chloro-4-methoxyphenoxy)-6-propan-2-ylnaphthalene
CID 91325108
(6-methoxyquinolin-2-yl)methanamine;dihydrochloride
CID 47002728
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
N-[2-(7-methoxy-3-methylisoquinolin-1-yl)ethyl]acetamide
CID 162686325
N-(5-chloro-2,4-dimethoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33316078
N-[2-[2-(3-methyl-4-propan-2-yloxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68763349
N-(2-acetamidoethyl)-5-[(2-chloro-4-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide
CID 56747146
N-[4-(2,5-dimethoxyphenyl)but-3-enyl]acetamide
CID 170488942
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749

Frequently Asked Questions

What is the IUPAC name of N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide?
The IUPAC name of N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide (CID 68762927) is N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide is COc1ccc(Oc2ccc3nc(CCNC(C)=O)ccc3c2)c(Cl)c1.
What is the InChIKey of N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide?
The InChIKey is PNUKOKDUVRZRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2O3/c1-13(24)22-10-9-15-4-3-14-11-17(5-7-19(14)23-15)26-20-8-6-16(25-2)12-18(20)21/h3-8,11-12H,9-10H2,1-2H3,(H,22,24).
What are the key properties of N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide?
N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide has a molecular weight of 370.84 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[6-(2-chloro-4-methoxyphenoxy)quinolin-2-yl]ethyl]acetamide is sourced from PubChem (CID 68762927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).