N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide

C25H23N3O3 — CID 45240952

IUPACN-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide
SMILESCN(C(=O)c1cc(COc2cccc3cccnc23)on1)C1CCCc2ccccc21
InChIInChI=1S/C25H23N3O3/c1-28(22-12-4-8-17-7-2-3-11-20(17)22)25(29)21-15-19(31-27-21)16-30-23-13-5-9-18-10-6-14-26-24(18)23/h2-3,5-7,9-11,13-15,22H,4,8,12,16H2,1H3
InChIKeyVAPNYGLPWOAPBV-UHFFFAOYSA-N
MW413.48 g/mol
LogP4.95
Rot. Bonds5

About N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide

N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide (PubChem CID 45240952) has the molecular formula C25H23N3O3 and a molecular weight of 413.48 g/mol. Its IUPAC name is N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide
PubChem CID45240952
Molecular FormulaC25H23N3O3
Molecular Weight413.48 g/mol
Exact Mass413.17
IUPAC NameN-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide
SMILESCN(C(=O)c1cc(COc2cccc3cccnc23)on1)C1CCCc2ccccc21
InChIInChI=1S/C25H23N3O3/c1-28(22-12-4-8-17-7-2-3-11-20(17)22)25(29)21-15-19(31-27-21)16-30-23-13-5-9-18-10-6-14-26-24(18)23/h2-3,5-7,9-11,13-15,22H,4,8,12,16H2,1H3
InChIKeyVAPNYGLPWOAPBV-UHFFFAOYSA-N
XLogP4.95
TPSA68.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

N-[[(2S)-oxolan-2-yl]methyl]-N-propyl-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 26322660
N-(2-methylsulfanylethyl)-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 42566769
(4-cyclopentylpiperazin-1-yl)-[5-(quinolin-8-yloxymethyl)-1,2-oxazol-3-yl]methanone
CID 42216229
2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
CID 45208937
N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 42382062
5-chloro-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazine-2-carboxamide
CID 107371805
N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-4-carboxamide
CID 42916496
N-methyl-3-(pyrimidin-2-ylamino)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 46589652
2-bromo-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-4-carboxamide
CID 103754184
N,6-dimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-3-carboxamide
CID 31121176
4-amino-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-pyrrole-2-carboxamide
CID 61107600
N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide
CID 42944559

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide (CID 45240952) is N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide is CN(C(=O)c1cc(COc2cccc3cccnc23)on1)C1CCCc2ccccc21.
What is the InChIKey of N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is VAPNYGLPWOAPBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O3/c1-28(22-12-4-8-17-7-2-3-11-20(17)22)25(29)21-15-19(31-27-21)16-30-23-13-5-9-18-10-6-14-26-24(18)23/h2-3,5-7,9-11,13-15,22H,4,8,12,16H2,1H3.
What are the key properties of N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide?
N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 413.48 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 45240952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).