methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate

C24H26N2O4 — CID 70834063

IUPACmethyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate
SMILESCOC(=O)NC(C)c1ccc2nc(Oc3ccc(OCC4CC4)cc3C)ccc2c1
InChIInChI=1S/C24H26N2O4/c1-15-12-20(29-14-17-4-5-17)8-10-22(15)30-23-11-7-19-13-18(6-9-21(19)26-23)16(2)25-24(27)28-3/h6-13,16-17H,4-5,14H2,1-3H3,(H,25,27)
InChIKeyWQUCXPZBMWNQGR-UHFFFAOYSA-N
MW406.48 g/mol
LogP5.54
Rot. Bonds7

About methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate

methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate (PubChem CID 70834063) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate
PubChem CID70834063
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC Namemethyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate
SMILESCOC(=O)NC(C)c1ccc2nc(Oc3ccc(OCC4CC4)cc3C)ccc2c1
InChIInChI=1S/C24H26N2O4/c1-15-12-20(29-14-17-4-5-17)8-10-22(15)30-23-11-7-19-13-18(6-9-21(19)26-23)16(2)25-24(27)28-3/h6-13,16-17H,4-5,14H2,1-3H3,(H,25,27)
InChIKeyWQUCXPZBMWNQGR-UHFFFAOYSA-N
XLogP5.54
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.48
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate with MolForge

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Related Compounds

N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]propanamide
CID 70833755
N-[1-[2-[2-bromo-4-(cyclohexylmethoxy)phenoxy]quinolin-6-yl]ethyl]acetamide
CID 68759815
N-[1-[2-(3-methyl-4-pyridin-2-yloxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68758504
N-[1-[2-(4-ethylsulfanyl-2-methylphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68762911
1-[2-[2-chloro-4-(cyclopropylmethoxy)phenoxy]quinolin-6-yl]ethanone
CID 68759784
N-[1-[2-(2-bromo-4-ethoxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68761187
N-[1-[2-(3-bromo-4-ethoxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68760152
1-[2-[3-chloro-4-(cyclopropylmethoxy)phenoxy]quinolin-6-yl]ethanamine
CID 91092196
2-[2-[4-(2-cyclopropylethoxy)-2-methylphenoxy]quinolin-6-yl]acetaldehyde
CID 87564012
1-[2-(4-cyclopentyloxy-2-methylphenoxy)quinolin-6-yl]ethanamine
CID 91362991
N-[1-[2-[3-bromo-4-(2-methylpropoxy)phenoxy]quinolin-6-yl]ethyl]acetamide
CID 70833796
N-[1-[2-[4-[3-(cyclopropylmethoxy)phenoxy]phenyl]indazol-5-yl]ethyl]acetamide
CID 130472859

Frequently Asked Questions

What is the IUPAC name of methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate?
The IUPAC name of methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate (CID 70834063) is methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate.
What is the SMILES notation for methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate?
The canonical SMILES for methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate is COC(=O)NC(C)c1ccc2nc(Oc3ccc(OCC4CC4)cc3C)ccc2c1.
What is the InChIKey of methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate?
The InChIKey is WQUCXPZBMWNQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c1-15-12-20(29-14-17-4-5-17)8-10-22(15)30-23-11-7-19-13-18(6-9-21(19)26-23)16(2)25-24(27)28-3/h6-13,16-17H,4-5,14H2,1-3H3,(H,25,27).
What are the key properties of methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate?
methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate has a molecular weight of 406.48 g/mol, XLogP of 5.54, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[1-[2-[4-(cyclopropylmethoxy)-2-methylphenoxy]quinolin-6-yl]ethyl]carbamate is sourced from PubChem (CID 70834063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).